format-version: 1.2 ontology: go/imports/chebi_import property_value: http://purl.org/dc/elements/1.1/source http://purl.obolibrary.org/obo/go/releases/2023-11-20/extensions/bio-chebi.owl [Term] id: CHEBI:100 name: (-)-medicarpin subset: chebi_ph7_3 is_a: CHEBI:16114 ! medicarpin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10022 name: deoxynivalenol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:27136 ! triol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:55517 ! trichothecene relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:10036 name: wax ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:73702 ! wax [Term] id: CHEBI:10043 name: wogonin is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:50629 ! cyclooxygenase 2 inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10049 name: XTP is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:53012 ! xanthosine 5'-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:10106 name: zearalenone subset: chebi_ph7_3 is_a: CHEBI:25106 ! macrolide is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76990 ! mycoestrogen [Term] id: CHEBI:10115 name: zingiberene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:10119 name: ziprasidone is_a: CHEBI:24829 ! indolones is_a: CHEBI:26144 ! piperazines is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:55505 ! 1,2-benzisothiazole relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35476 ! antipsychotic agent relationship: has_role CHEBI:37956 ! histamine antagonist relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:48876 ! muscarinic antagonist [Term] id: CHEBI:1015 name: 2-aminobenzenesulfonic acid is_a: CHEBI:33557 ! aminobenzenesulfonic acid [Term] id: CHEBI:10213 name: alpha-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:10216 name: cedr-8-ene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:10221 name: alpha-copaene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:10223 name: alpha-cryptoxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol [Term] id: CHEBI:10275 name: (9Z,11E,13E)-octadeca-9,11,13-trienoic acid is_a: CHEBI:38382 ! 9,11,13-octadecatrienoic acid [Term] id: CHEBI:10278 name: alpha-eudesmol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:62508 ! eudesmane sesquiterpenoid relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:10280 name: (E,E)-alpha-farnesene subset: chebi_ph7_3 is_a: CHEBI:39236 ! alpha-farnesene [Term] id: CHEBI:10283 name: 2-hydroxy fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:10329 name: alpha-ribazole subset: chebi_ph7_3 is_a: CHEBI:23809 ! dimethylbenzimidazole is_a: CHEBI:47917 ! 1-ribosylbenzimidazole relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:10334 name: alpha-terpinene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:37613 ! cyclohexadiene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10352 name: beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:10357 name: (-)-beta-caryophyllene subset: chebi_ph7_3 is_a: CHEBI:63191 ! beta-caryophyllene relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:10359 name: (-)-beta-chamigrene subset: chebi_ph7_3 is_a: CHEBI:61744 ! beta-chamigrene [Term] id: CHEBI:10362 name: beta-cryptoxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:67200 ! provitamin A relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10363 name: beta-cubebene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10365 name: (5S)-3-acetyl-4-hydroxy-5-\{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}-1,5-dihydro-2H-pyrrol-2-one is_a: CHEBI:22838 ! beta-cyclopiazonic acid [Term] id: CHEBI:104120 name: alpha-methylene gamma-butyrolactone subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide relationship: has_role CHEBI:49201 ! anti-ulcer drug relationship: has_role CHEBI:55324 ! gastrointestinal drug [Term] id: CHEBI:10415 name: beta-endorphin is_a: CHEBI:15841 ! polypeptide relationship: has_role CHEBI:25512 ! neurotransmitter [Term] id: CHEBI:10417 name: beta-eudesmol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:62508 ! eudesmane sesquiterpenoid relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:10418 name: trans-beta-farnesene subset: chebi_ph7_3 is_a: CHEBI:39241 ! beta-farnesene relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:72575 ! alarm pheromone [Term] id: CHEBI:10436 name: beta-ocimene subset: chebi_ph7_3 is_a: CHEBI:87751 ! ocimene [Term] id: CHEBI:10440 name: (-)-beta-santalene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:10443 name: (+)-beta-selinene subset: chebi_ph7_3 is_a: CHEBI:49276 ! beta-selinene [Term] id: CHEBI:10502 name: dTDP-3-amino-3,4,6-trideoxy-alpha-D-glucose is_a: CHEBI:28375 ! dTDP-3-amino-3,4,6-trideoxy-D-glucose [Term] id: CHEBI:10525 name: dTDP-beta-L-mycarose is_a: CHEBI:23557 ! dTDP-sugar relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:10545 name: electron subset: chebi_ph7_3 is_a: CHEBI:36338 ! lepton [Term] id: CHEBI:10576 name: (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene subset: chebi_ph7_3 is_a: CHEBI:23139 ! chlorocyclohexene [Term] id: CHEBI:10577 name: gamma-terpinene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:37613 ! cyclohexadiene relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:1060 name: 2-dehydro-3-deoxy-D-arabinonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33753 ! pentonic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid [Term] id: CHEBI:10615 name: omega-hydroxy fatty acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:106304 name: sphingomyelin d18:1/16:0 subset: chebi_ph7_3 is_a: CHEBI:17636 ! sphingomyelin d18:1 is_a: CHEBI:72514 ! sphingomyelin 34:1 [Term] id: CHEBI:10642 name: scyllo-inositol subset: chebi_ph7_3 is_a: CHEBI:24848 ! inositol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:10668 name: tRNA precursor is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:10696 name: (3S)-3-hydroxy-L-aspartic acid is_a: CHEBI:48423 ! 3-hydroxy-L-aspartic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:10698 name: 2-cis,6-trans,10-trans-geranylgeranyl diphosphate is_a: CHEBI:15831 ! geranylgeranyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:10702 name: (1R,2R)-cyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:16740 ! trans-cyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:10723 name: trans-dec-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:10782 name: (S)-(-)-perillyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15420 ! perillyl alcohol [Term] id: CHEBI:10790 name: methylenediurea subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:10836 name: 2',3,4,4',6'-pentahydroxychalcone is_a: CHEBI:23086 ! chalcones [Term] id: CHEBI:10956 name: (E)-cinnamoyl-CoA is_a: CHEBI:15463 ! cinnamoyl-CoA [Term] id: CHEBI:10965 name: (R)-2,3,4,5-tetrahydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:11408 ! 2,3,4,5-tetrahydrodipicolinate(2-) [Term] id: CHEBI:10970 name: (R)-2-benzylsuccinyl-CoA is_a: CHEBI:22746 ! 2-benzylsuccinyl-CoA [Term] id: CHEBI:10979 name: (R)-3-[(R)-3-hydroxybutanoyloxy]butanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:10980 name: (R)-3-(4-hydroxyphenyl)lactate subset: chebi_ph7_3 is_a: CHEBI:36659 ! 3-(4-hydroxyphenyl)lactate is_a: CHEBI:58314 ! (2R)-2-hydroxy monocarboxylic acid anion [Term] id: CHEBI:10983 name: (R)-3-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:37054 ! 3-hydroxybutyrate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:10986 name: (R)-4'-phosphonatopantothenate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11009 name: (R)-3-phenyllactate subset: chebi_ph7_3 is_a: CHEBI:58314 ! (2R)-2-hydroxy monocarboxylic acid anion is_a: CHEBI:8100 ! 3-phenyllactate [Term] id: CHEBI:11010 name: (R)-phenyllactoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:11022 name: (S)-4-amino-5-oxopentanoate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:71666 ! gamma-amino acid anion [Term] id: CHEBI:11041 name: (S)-3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:11047 name: (S)-3-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:37054 ! 3-hydroxybutyrate [Term] id: CHEBI:11060 name: (S)-carnitine subset: chebi_ph7_3 is_a: CHEBI:17126 ! carnitine [Term] id: CHEBI:1107 name: 2-hexaprenyl-6-hydroxyphenol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:1109 name: 2-hexaprenyl-6-methoxyphenol subset: chebi_ph7_3 is_a: CHEBI:62731 ! 2-methoxy-6-(all-trans-polyprenyl)phenol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:1110 name: 2-hexaprenylphenol subset: chebi_ph7_3 is_a: CHEBI:1269 ! 2-polyprenylphenol [Term] id: CHEBI:111006 name: maltose 6'-phosphate is_a: CHEBI:25143 ! maltose phosphate [Term] id: CHEBI:1113 name: cis-2-hydroxypenta-2,4-dienoic acid is_a: CHEBI:18355 ! 2-hydroxypenta-2,4-dienoic acid [Term] id: CHEBI:111503 name: validamine 7-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:111504 name: validoxylamine A 7'-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:111505 name: validoxylamine A(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:111509 name: alpha-L-colitosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosamine subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide is_a: CHEBI:63339 ! deoxy oligosaccharide derivative [Term] id: CHEBI:111511 name: (beta-D-glucopyranosyloxymethyl)deoxyuridine 5'-monophosphate is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:111519 name: 2,3-dichloromuconic acid is_a: CHEBI:38422 ! dichloromuconic acid [Term] id: CHEBI:11152 name: 1,2-didecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:111521 name: valienone subset: chebi_ph7_3 is_a: CHEBI:33573 ! tetrol is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:111522 name: valienone 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:111523 name: validone 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:111542 name: validone subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:24693 ! hydroxycyclohexanone is_a: CHEBI:33573 ! tetrol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:111544 name: 2'-hydroxyrifampicin is_a: CHEBI:26580 ! rifamycins relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:11173 name: 1,4-dihydroxy-2-naphthoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:111763 name: N-demethylindolmycin is_a: CHEBI:24828 ! indoles is_a: CHEBI:46812 ! 1,3-oxazoles is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:112106 name: (R)-3-(indol-3-yl)-2-oxobutyric acid is_a: CHEBI:28549 ! 3-(indol-3-yl)-2-oxobutyric acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:11222 name: 1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium subset: chebi_ph7_3 is_a: CHEBI:38188 ! pyridinium salt is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:11230 name: 1-acylglycerophosphocholine(1+) is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:112505 name: 2-amino-3-hydroxy-4-methylbenzoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:11302 name: 10-desacetyltaxuyunnanin C subset: chebi_ph7_3 is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:11305 name: 10-hydroxycaprate subset: chebi_ph7_3 is_a: CHEBI:194241 ! omega-hydroxy-medium-chain fatty acid anion [Term] id: CHEBI:11320 name: 13-hydroxydocosanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:1135 name: 2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:11369 name: 1L-myo-inositol 1,2,3,4,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate [Term] id: CHEBI:11392 name: 2'-(5-triphosphoribosyl)-3'-dephospho-CoA is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:11408 name: 2,3,4,5-tetrahydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:11412 name: (2R,3S,4S)-leucocyanidin subset: chebi_ph7_3 is_a: CHEBI:138176 ! (2R,3S,4S)-leucoanthocyanidin is_a: CHEBI:15758 ! leucocyanidin [Term] id: CHEBI:11421 name: 2,3-dihydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:14148 ! dihydrodipicolinate(2-) [Term] id: CHEBI:11424 name: 2,3-dihydroxy-3-methylbutanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:11438 name: 2,4-dichloro-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38412 ! 2,4-dichloromuconate(2-) [Term] id: CHEBI:11449 name: 2,5-didehydro-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:1148 name: 2-hydroxybutyric acid is_a: CHEBI:24684 ! hydroxybutyric acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:114953 name: (2S)-2-ammonio-5-\{[iminio(methylamino)methyl]amino}pentanoate subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:11502 name: 2-acylglycerophosphocholine is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:11515 name: 2-amino-5-formylamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:38339 ! formamidopyrimidine [Term] id: CHEBI:1156 name: 2-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:36857 ! 2-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11561 name: 2-dehydropantoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:11563 name: 2-deoxy-alpha-D-ribose 1-phosphate is_a: CHEBI:28542 ! 2-deoxy-D-ribofuranose 1-phosphate [Term] id: CHEBI:1157 name: isethionic acid is_a: CHEBI:47901 ! alkanesulfonic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:1159 name: 2-hydroxyethylphosphonic acid is_a: CHEBI:26069 ! phosphonic acids [Term] id: CHEBI:11594 name: 2-coumarate subset: chebi_ph7_3 is_a: CHEBI:23399 ! coumarate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:11596 name: 2-hydroxyglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:132941 ! 2-hydroxyglutarate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:11614 name: 2-methylbut-2-enoyl-coenzyme A is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15469 ! alk-2-enoyl-CoA [Term] id: CHEBI:116314 name: oleamide subset: chebi_ph7_3 is_a: CHEBI:143129 ! primary fatty amide relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11641 name: 2-oxopent-4-enoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:11656 name: 2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:11684 name: 3,3',5'-triiodo-L-thyronine is_a: CHEBI:28774 ! 3,3',5'-triiodothyronine [Term] id: CHEBI:116931 name: nipecotic acid is_a: CHEBI:26148 ! piperidinemonocarboxylic acid is_a: CHEBI:33706 ! beta-amino acid [Term] id: CHEBI:1171 name: 2-hydroxypropylphosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:11750 name: 3-sn-phosphatidyl-L-serine is_a: CHEBI:18303 ! phosphatidyl-L-serine [Term] id: CHEBI:1178 name: (2S)-2-isopropylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:167114 ! 2-hydroxydicarboxylate(2-) is_a: CHEBI:28107 ! 2-isopropylmalate(2-) [Term] id: CHEBI:11791 name: 3-deoxy-D-manno-octulosonic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:11805 name: 3-hydroxyisobutyrate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11807 name: 5-hydroxy-6-methylpyridine-3,4-dicarboxylate is_a: CHEBI:36173 ! pyridinedicarboxylate [Term] id: CHEBI:11812 name: 3-hydroxy-3-methyl-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:11814 name: 3-hydroxy-3-methylglutaryl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:1184 name: maleylacetic acid is_a: CHEBI:19672 ! 4-oxohex-2-enedioic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:11851 name: 3-methyl-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:191201 ! branched-chain keto acid anion is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:58955 ! branched-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11867 name: 3-oxo-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:1189 name: 2-methoxyestrone subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11892 name: N-carbamoyl-beta-alaninate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11893 name: 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:119 name: D-synephrine is_a: CHEBI:29081 ! synephrine [Term] id: CHEBI:11901 name: 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:11909 name: 3beta-hydroxy-5alpha-pregnan-20-one subset: chebi_ph7_3 is_a: CHEBI:50170 ! 3-hydroxy-5alpha-pregnan-20-one [Term] id: CHEBI:11935 name: 4-(beta-D-glucosyloxy)benzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:11944 name: 4-(hydroxymethyl)benzenesulfonate subset: chebi_ph7_3 is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:11946 name: 4-(trimethylammonio)but-2-enoate subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine [Term] id: CHEBI:11951 name: 4-acetamidobutanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:11955 name: 4-amino-3-hydroxybutanoate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:71666 ! gamma-amino acid anion [Term] id: CHEBI:11972 name: 4-carboxymethylenebut-2-en-4-olide is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:11986 name: 4-fluoro-L-threonine is_a: CHEBI:24068 ! fluoroamino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:11987 name: 4-formylbenzenesulfonate subset: chebi_ph7_3 is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:12040 name: 4-oxohex-2-enedioate subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:12060 name: 5'-deoxy-5'-fluoroadenosine subset: chebi_ph7_3 is_a: CHEBI:22260 ! adenosines is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:12071 name: 5,10-methylenetetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:67016 ! tetrahydrofolate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:12109 name: 5-aminolevulinate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:12113 name: 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:12154 name: 5-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:12164 name: 5-phosphoribosyl diphosphate is_a: CHEBI:21080 ! ribose diphosphate is_a: CHEBI:35158 ! ribose bisphosphate [Term] id: CHEBI:12194 name: 6-(N-acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol is_a: CHEBI:12195 ! 6-O-(N-acetyl-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:12195 name: 6-O-(N-acetyl-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol is_a: CHEBI:15935 ! N-acetyl-D-glucosaminylphosphatidylinositol [Term] id: CHEBI:122 name: (-)-usnic acid is_a: CHEBI:38319 ! usnic acid relationship: has_role CHEBI:38317 ! EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor [Term] id: CHEBI:12266 name: 8-amino-7-oxononanoate is_a: CHEBI:35984 ! 7-oxo monocarboxylic acid anion [Term] id: CHEBI:1230 name: sophorose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:1233 name: 3-(all-trans-octaprenyl)benzene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:62729 ! 3-(all-trans-polyprenyl)benzene-1,2-diol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:12336 name: alpha-cyclopiazonic acids is_a: CHEBI:38615 ! cyclopiazonic acid [Term] id: CHEBI:1235 name: 2-methoxy-6-(all-trans-octaprenyl)phenol subset: chebi_ph7_3 is_a: CHEBI:62731 ! 2-methoxy-6-(all-trans-polyprenyl)phenol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:12350 name: beta-D-fructofuranose 2-phosphate is_a: CHEBI:27884 ! D-fructofuranose 2-phosphate [Term] id: CHEBI:12357 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl group subset: chebi_ph7_3 is_a: CHEBI:17571 ! beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl group is_a: CHEBI:21524 ! N-acetyl-D-glucosaminyl groups relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:12387 name: beta-L-fucose 1-phosphate is_a: CHEBI:28319 ! L-fucopyranose 1-phosphate [Term] id: CHEBI:12427 name: N,N'-diacetylchitobiosyldiphosphodolichol is_a: CHEBI:18341 ! diacetylchitobiosyldiphosphodolichol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:124959 name: (2S)-2-amino-5-[[amino(methylimino)methyl]amino]pentanoic acid is_a: CHEBI:22617 ! arginine derivative [Term] id: CHEBI:12532 name: N,N-dihydroxy-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:125678 name: N-acetyldopamine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:157740 ! N-(fatty acyl)-dopamine is_a: CHEBI:22160 ! acetamides is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:1269 name: 2-polyprenylphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:60027 ! polymer is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:127343 name: 17-(4-hydroxyphenyl)heptadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:127547 name: 19-(4-hydroxyphenyl)nonadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:12755 name: indol-3-ylacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:12777 name: vitamin A is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:24020 ! fat-soluble vitamin (role) relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:127780 name: phosphonoformic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:36044 ! antiviral drug relationship: has_role CHEBI:53756 ! HIV-1 reverse transcriptase inhibitor relationship: has_role CHEBI:63330 ! sodium-dependent Pi-transporter inhibitor [Term] id: CHEBI:127781 name: 17-(4-hydroxyphenyl)heptadecanoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:128 name: (S)-(-)-alpha-terpineol subset: chebi_ph7_3 is_a: CHEBI:22469 ! alpha-terpineol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:128120 name: 19-(4-hydroxyphenyl)nonadecanoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:12834 name: n-alkanal subset: chebi_ph7_3 is_a: CHEBI:59768 ! aliphatic aldehyde [Term] id: CHEBI:128459 name: valienol 1-phosphate is_a: CHEBI:23450 ! cyclitol phosphate [Term] id: CHEBI:12855 name: (1S,2S)-cyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:16740 ! trans-cyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:12875 name: trans-2-coumarate subset: chebi_ph7_3 is_a: CHEBI:11594 ! 2-coumarate [Term] id: CHEBI:128753 name: (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59544 ! phosphoantigen [Term] id: CHEBI:128754 name: GDP-valienol is_a: CHEBI:23450 ! cyclitol phosphate is_a: CHEBI:47784 ! nucleotide conjugate relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:12876 name: trans-4-coumarate subset: chebi_ph7_3 is_a: CHEBI:32373 ! 4-coumarate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:128769 name: isopentenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59544 ! phosphoantigen relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:128770 name: 12,18-dihydroxyoctadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid [Term] id: CHEBI:12886 name: (R)-4'-phosphopantothenate(1-) is_a: CHEBI:37481 ! amidoalkyl phosphate [Term] id: CHEBI:129 name: (-)-beta-phellandrene subset: chebi_ph7_3 is_a: CHEBI:48741 ! beta-phellandrene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:129091 name: (9Z,12R)-12,18-dihydroxyoctadecenoic acid is_a: CHEBI:131869 ! hydroxy monounsaturated fatty acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid [Term] id: CHEBI:12931 name: D-galactonate subset: chebi_ph7_3 is_a: CHEBI:24148 ! galactonate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:12936 name: D-galactose is_a: CHEBI:17608 ! D-aldohexose is_a: CHEBI:28260 ! galactose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:12937 name: D-galactose 6-phosphate is_a: CHEBI:20960 ! galactose phosphate relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:1294 name: (20R,22R)-20,22-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:12952 name: aldehydo-D-galacturonate subset: chebi_ph7_3 is_a: CHEBI:24175 ! galacturonate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:12962 name: D-glucosamine 6-phosphate is_a: CHEBI:24269 ! glucosamine phosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:130073 name: 5,20-diHEPE is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:13022 name: keto-D-sorbose subset: chebi_ph7_3 is_a: CHEBI:17317 ! D-sorbose [Term] id: CHEBI:13043 name: 3-amino-L-alaninate is_a: CHEBI:49983 ! 3-aminoalaninate [Term] id: CHEBI:1307 name: 24-methylenecycloartanol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:13086 name: L-aspartate 4-semialdehyde is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:13115 name: L-gulonate subset: chebi_ph7_3 is_a: CHEBI:24461 ! gulonate relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:131198 name: (Z)-1,2-ethenediol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:33823 ! enol [Term] id: CHEBI:131367 name: 3-hydroxy-3-butenoic acid is_a: CHEBI:1549 ! 3-hydroxymonocarboxylic acid is_a: CHEBI:33823 ! enol [Term] id: CHEBI:131401 name: hexopyranosyl hexopyranoside is_a: CHEBI:24407 ! glycosyl glycoside [Term] id: CHEBI:131429 name: carcinine is_a: CHEBI:22823 ! beta-alanine derivative is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:83039 ! crustacean metabolite [Term] id: CHEBI:131436 name: N-acetyl-L-phosphinothricin is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:52057 ! N-acetylphosphinothricin [Term] id: CHEBI:131444 name: guanidinoacetate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:131445 name: 4-methylpentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131446 name: 2-aminobenzoylacetate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:131447 name: 2-aminobenzoylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:131448 name: beta-D-Manp-(1->2)-beta-D-Manp-(1->2)-D-Manp subset: chebi_ph7_3 is_a: CHEBI:146181 ! mannotriose [Term] id: CHEBI:131450 name: 2,6-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:131487 name: 1,2-diacyl-3-(alpha-D-6-sulfoquinovosyl)-sn-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:131522 name: dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-alpha-D-glucose is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131528 name: aurachin B is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:90917 ! A-type aurachin relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131530 name: pyridoxal(1+) is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:131533 name: pyridoxamine(2+) is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:131561 name: hyaluronic acid synthesis inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:131562 name: (5S,15S)-5-hydroperoxy-15-HETE is_a: CHEBI:90833 ! 5-hydroperoxy-15-HETE [Term] id: CHEBI:131564 name: (5S,15S)-5-hydroperoxy-15-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:90631 ! 5-hydroperoxy-15-HETE(1-) [Term] id: CHEBI:131565 name: steroid aldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131572 name: 3'-L-prolyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:46874 ! alpha-amino acid ester is_a: CHEBI:84186 ! L-proline derivative relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:131579 name: pApA is_a: CHEBI:48638 ! 5'-phospho-(3'->5')-dinucleotide relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:131582 name: 8,12-diethyl-3-vinylbacteriochlorophyllide d is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131587 name: 12-ethyl-8-propyl-3-vinylbacteriochlorophyllide d is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131588 name: 12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide d is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131589 name: 3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid 9-phosphate is_a: CHEBI:24962 ! ketoaldonic acid phosphate is_a: CHEBI:63436 ! carbohydrate acid derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131591 name: C18-steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131593 name: 3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid is_a: CHEBI:71429 ! deaminoneuraminic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131596 name: CMP-3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid is_a: CHEBI:20878 ! CMP-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131602 name: CMP-8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid is_a: CHEBI:20878 ! CMP-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131603 name: sucrose 6(G)-phosphate is_a: CHEBI:23843 ! disaccharide phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:131604 name: Mycoplasma genitalium metabolite is_a: CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131605 name: dicarboxylic acid monoester(1-) is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:131610 name: O-(beta-L-arabinofuranosyl)-trans-4-hydroxy-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:131617 name: 18-oxoresolvin E1 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid is_a: CHEBI:61703 ! nonclassic icosanoid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:131619 name: C27-steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131620 name: C24-steroid is_a: CHEBI:131657 ! cholane derivative [Term] id: CHEBI:131621 name: C19-steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131622 name: steroidal acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:131632 name: lanostane derivative is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131634 name: pregnane derivative is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131635 name: estrane derivative is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131636 name: GDP-4-amino-3,4,6-trideoxy-alpha-D-threo-hex-3-enopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:131637 name: lanostane sterol is_a: CHEBI:131632 ! lanostane derivative is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:131639 name: GDP-(2S,3S,6R)-3-hydroxy-5-imino-6-methyloxane(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:131643 name: ketocholestane is_a: CHEBI:35789 ! oxo steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:131647 name: androstane sulfate is_a: CHEBI:131737 ! androstane ester is_a: CHEBI:16158 ! steroid sulfate [Term] id: CHEBI:131650 name: phosphinomethylisomalate(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:131651 name: 2-(phosphinatomethylidene)succinate(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:131652 name: cholestanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:131657 name: cholane derivative is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131698 name: pregnane sterol is_a: CHEBI:131634 ! pregnane derivative is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:131699 name: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor is_a: CHEBI:38234 ! DNA polymerase inhibitor [Term] id: CHEBI:13170 name: Ser-tRNA(Sec) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA [Term] id: CHEBI:131701 name: poly(ethylene terephthalate)(1-) subset: chebi_ph7_3 is_a: CHEBI:37997 ! homopolymer macromolecule is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:131702 name: stigmastane derivative is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:131703 name: stigmastane sterol is_a: CHEBI:131702 ! stigmastane derivative is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:131704 name: 4-[(2-hydroxyethoxy)carbonyl]benzoate subset: chebi_ph7_3 is_a: CHEBI:131605 ! dicarboxylic acid monoester(1-) [Term] id: CHEBI:131705 name: 2'-deoxynucleoside 3'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:131706 name: (2Z,4S,5R)-2-amino-4,5,6-trihydroxyhex-2-enoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:131707 name: (4S,5R)-4,5,6-trihydroxy-2-iminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:131708 name: N(omega)-(1-hydroxy-2-oxopropyl)-L-arginine residue(1+) subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:131709 name: N(6)-(1-hydroxy-2-oxopropyl)-L-lysine residue(1+) subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:131710 name: S-(1-hydroxy-2-oxopropyl)-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:131711 name: (S)-demethyl-4-deoxygadusol(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:131717 name: 2-epi-valiolone subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131718 name: S-(1-hydroxy-2-methylbut-3-en-2-yl)glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:13172 name: keto-L-sorbose subset: chebi_ph7_3 is_a: CHEBI:17266 ! L-sorbose [Term] id: CHEBI:131720 name: (3R)-3,4-epoxy-3-methylbut-1-ene subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:131725 name: coproporphyrin III(4-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:131727 name: hydroxylipid subset: chebi_ph7_3 is_a: CHEBI:18059 ! lipid is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:131728 name: [Glu(-Cys)]n-Gly(1-) subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:13173 name: L-tagatose 6-phosphate is_a: CHEBI:49094 ! tagatose 6-phosphate [Term] id: CHEBI:131735 name: 4-[(2-hydroxyethoxy)carbonyl]benzoic acid is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:131737 name: androstane ester is_a: CHEBI:47880 ! steroid ester is_a: CHEBI:50402 ! androstanoid [Term] id: CHEBI:131739 name: lysophosphatidylcholine (18:1/0:0) subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64566 ! lysophosphatidylcholine 18:1 relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:131745 name: lysophosphatidylethanolamine (0:0/18:2) is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:91296 ! lysophosphatidylethanolamine 18:2 relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:131747 name: lanostane ester is_a: CHEBI:131632 ! lanostane derivative is_a: CHEBI:47880 ! steroid ester [Term] id: CHEBI:131748 name: ergostane ester is_a: CHEBI:47880 ! steroid ester is_a: CHEBI:50403 ! ergostanoid [Term] id: CHEBI:131759 name: CMP-5'-phosphonoformic acid is_a: CHEBI:23521 ! cytidine 5'-phosphate is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131766 name: (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:131767 name: D-erythrulose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:131780 name: 2-hydroxyisobutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:131783 name: indolmycenate subset: chebi_ph7_3 is_a: CHEBI:58123 ! (2S)-2-hydroxy monocarboxylic acid anion [Term] id: CHEBI:131797 name: S-(2-carboxy-2-methylbut-3-en-2-yl)glutathione(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:131798 name: S-(2-methyl-1-oxobut-3-en-2-yl)glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:131803 name: L-allysine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:131822 name: sulfamate subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:131823 name: methylated primary amine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:131845 name: 2-methylpropane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:131846 name: 2-hydroxy-2-methylpropanal subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:50413 ! hydroxyaldehyde relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:131847 name: 2,4-didehydro-3-deoxy-L-rhamnonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:131849 name: D-erythritol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:131856 name: 3,5-dimethylorsellinate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:131857 name: (3R)-farnesyl-2,3,5-trimethyl-6-oxido-4-oxocyclohexa-1,5-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:131858 name: HETE anion is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131859 name: oxo-ETE anion subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:131860 name: octadecanoid anion is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:131861 name: HODE(1-) is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:131862 name: HPODE(1-) is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion [Term] id: CHEBI:131863 name: docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:131864 name: docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:131865 name: EET(1-) is_a: CHEBI:190711 ! epoxy fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131867 name: hydroxydocosahexaenoate is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion [Term] id: CHEBI:131868 name: hydroperoxydocosahexaenoate is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion [Term] id: CHEBI:131869 name: hydroxy monounsaturated fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid [Term] id: CHEBI:131870 name: hydroxy monounsaturated fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:131871 name: hydroxy polyunsaturated fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:131872 name: hydroxy saturated fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:131873 name: EpETE(1-) is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131874 name: HEPE(1-) is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131875 name: hydroperoxyicosatrienoate is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131876 name: hydroperoxyicosapentaenoate is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131877 name: dihydroxyicosatetraenoate is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:131878 name: cholanic acid anion is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:131879 name: cholanic acid conjugate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:131889 name: 11-HEPE is_a: CHEBI:72799 ! HEPE relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:131894 name: N-arachidonoylethanolamine phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145497 ! N-acylethanolamine phosphate(2-) is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:131906 name: 4-pyranones is_a: CHEBI:37963 ! pyranone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:131907 name: 3-pyrones is_a: CHEBI:37963 ! pyranone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:131912 name: O-[S-(3-hydroxy-4-methylanthraniloyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:131913 name: O-[S-(3,5-dihydroxy-4-methylanthraniloyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:131914 name: violacein subset: chebi_ph7_3 is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131915 name: deoxyviolacein subset: chebi_ph7_3 is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131916 name: proviolacein subset: chebi_ph7_3 is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131919 name: nocardicin G zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:131920 name: isonocardicin C dizwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:131921 name: ethylenediaminetriacetate(2-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:131922 name: ethylenediaminediacetate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:131927 name: dicarboxylic acids and O-substituted derivatives is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:131928 name: N-hydroxy-2-methylpropanamine subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131929 name: (E)-3-(indol-3-yl)acrylate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:13193 name: hydrogen acceptor subset: chebi_ph7_3 is_a: CHEBI:17654 ! electron acceptor [Term] id: CHEBI:131930 name: validamine 7-phosphate is_a: CHEBI:23450 ! cyclitol phosphate is_a: CHEBI:61689 ! amino cyclitol [Term] id: CHEBI:131932 name: glycosmisate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:131933 name: (-)-DCA-CL(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:131934 name: (-)-DCA-CC(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131935 name: (+)-DCA-CC(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131936 name: (+)-DCA-CL(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:131937 name: ent-glycosmisate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:131938 name: validoxylamine A 7'-phosphate is_a: CHEBI:23450 ! cyclitol phosphate is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:61689 ! amino cyclitol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131941 name: validoxylamine A is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:61689 ! amino cyclitol relationship: has_role CHEBI:39208 ! antibiotic insecticide relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:83762 ! EC 3.2.1.28 (alpha,alpha-trehalase) inhibitor [Term] id: CHEBI:131943 name: (5E)-tetradecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:131944 name: (2E,5E)-tetradecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:131946 name: valienone 7-phosphate is_a: CHEBI:27136 ! triol is_a: CHEBI:36949 ! hydroxyalkyl phosphate is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51689 ! enone [Term] id: CHEBI:131948 name: nocardicin C dizwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:131949 name: validone 7-phosphate is_a: CHEBI:23450 ! cyclitol phosphate is_a: CHEBI:24693 ! hydroxycyclohexanone is_a: CHEBI:27136 ! triol [Term] id: CHEBI:131950 name: 2-aminobenzoylacetic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:48975 ! substituted aniline relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131951 name: 4-methylpentanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:131952 name: 2-aminobenzoylacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131954 name: GDP-4-amino-3,4,6-trideoxy-alpha-D-threo-hex-3-enopyranose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:131955 name: (5E)-tetradecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:131957 name: (5E)-tetradecenoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:85449 ! O-tetradecenoyl-L-carnitine relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:131958 name: (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157774 ! epoxydocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:131959 name: phosphinomethylisomalic acid is_a: CHEBI:26044 ! phosphinic acids is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:131962 name: (3E)-octenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:131963 name: 2-(phosphinomethylidene)succinic acid is_a: CHEBI:26044 ! phosphinic acids is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:131964 name: (14S,15R)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:84024 ! 14,15-EET(1-) [Term] id: CHEBI:131965 name: (14R,15S)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:84024 ! 14,15-EET(1-) [Term] id: CHEBI:131966 name: (2Z,4S,5R)-2-amino-4,5,6-trihydroxyhex-2-enoic acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:63442 ! hexonic acid derivative [Term] id: CHEBI:131967 name: (4S,5R)-4,5,6-trihydroxy-2-iminohexanoic acid is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:33272 ! ketimine is_a: CHEBI:63442 ! hexonic acid derivative [Term] id: CHEBI:131969 name: (11S,12R)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:76625 ! 11,12-EET(1-) [Term] id: CHEBI:13197 name: ribonucleoside 3'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:63165 ! ribonucleoside monophosphate oxoanion [Term] id: CHEBI:131970 name: (11R,12S)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:76625 ! 11,12-EET(1-) [Term] id: CHEBI:131971 name: (1R,5aS,6R)-1,4,5,5a,6,9-hexahydrophenazine-1,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131973 name: (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131974 name: (8S,9R)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:84025 ! 8,9-EET(1-) [Term] id: CHEBI:131975 name: (8R,9S)-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:84025 ! 8,9-EET(1-) [Term] id: CHEBI:131978 name: (5aS)-5,5a-dihydrophenazine-1,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131979 name: 5,10-dihydrophenazine-1,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131980 name: phenazine-1,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:131981 name: (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:131986 name: 1-docosahexaenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64567 ! lysophosphatidylcholine 22:6 [Term] id: CHEBI:131987 name: 2-docosahexaenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64567 ! lysophosphatidylcholine 22:6 [Term] id: CHEBI:131990 name: (2E,5Z)-octadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:85097 ! 4-saturated trans-2-enoyl-CoA(4-) [Term] id: CHEBI:131992 name: 5,6-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:131865 ! EET(1-) [Term] id: CHEBI:132001 name: cholesteryl octadecenoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:132002 name: cholesteryl octadecadienoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:132003 name: (10aS)-10,10a-dihydrophenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:132004 name: cholesteryl octadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:132005 name: (1R)-1,4,5,10-tetrahydrophenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:132006 name: cholesteryl icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:132007 name: cholesteryl icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:132008 name: 5,10-dihydrophenazine subset: chebi_ph7_3 is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132011 name: S-butyryl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132012 name: S-hexanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132013 name: S-octanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132014 name: S-decanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132015 name: S-dodecanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132016 name: 17-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:132017 name: S-tetradecanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132018 name: S-hexadecanoyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132019 name: 16-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:132020 name: S-choloyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132021 name: S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:132023 ! S-acyl-4'-phosphopantetheine(2-) [Term] id: CHEBI:132022 name: 12-hydroxyjasmonate subset: chebi_ph7_3 is_a: CHEBI:136810 ! 12-hydroxyjasmonates [Term] id: CHEBI:132023 name: S-acyl-4'-phosphopantetheine(2-) subset: chebi_ph7_3 is_a: CHEBI:67051 ! phosphopantetheine anion [Term] id: CHEBI:132024 name: 19-HETrE(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:132025 name: 21-HDoHE(1-) subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:132026 name: 20-HETrE(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:132028 name: tauroursodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:132030 name: glycoursodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:132031 name: 13-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:132040 name: fatty acid-taurine conjugate(1-) subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:132042 name: N-dodecanoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132043 name: N-tetradecanoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132044 name: Deoxymethylsphingoid base is_a: CHEBI:35785 ! sphingoid is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:132045 name: N-hexadecanoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132046 name: Deoxysphingoid base is_a: CHEBI:35785 ! sphingoid is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:132047 name: N-stearoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132048 name: N-icosanoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132049 name: N-tetracosanoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132052 name: (S)-demethyl-4-deoxygadusol is_a: CHEBI:33573 ! tetrol is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51689 ! enone [Term] id: CHEBI:132060 name: N-arachidonoyltaurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132061 name: N-[12(S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]taurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132062 name: N-[15(S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]taurine(1-) subset: chebi_ph7_3 is_a: CHEBI:132040 ! fatty acid-taurine conjugate(1-) [Term] id: CHEBI:132063 name: (12S)-hydroperoxy-(14R,15S)-epoxy-(5Z,8Z,10E)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:133652 ! hydroperoxy(epoxy)icosatrienoate [Term] id: CHEBI:132064 name: 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:194353 ! (9Z)-11-hydroxy-12,13-epoxyoctadecenoate(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:132065 name: (12S)-hydroperoxy-(14S,15R)-epoxy-(5Z,8Z,10E)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:133652 ! hydroperoxy(epoxy)icosatrienoate [Term] id: CHEBI:132066 name: S-(1-hydroxy-2-methylbut-3-en-2-yl)glutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:132067 name: (5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:133652 ! hydroperoxy(epoxy)icosatrienoate [Term] id: CHEBI:132068 name: (8S)-hydroperoxy-(14S,15R)-epoxy-(5Z,9E,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:133652 ! hydroperoxy(epoxy)icosatrienoate [Term] id: CHEBI:132069 name: (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate is_a: CHEBI:36982 ! cyclic purine nucleotide [Term] id: CHEBI:132070 name: eoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:132071 name: N-arachidonoyl-L-alaninate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:176556 ! N-(fatty acyl)-L-alaninate(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:132072 name: N-arachidonoyl-gamma-aminobutyrate subset: chebi_ph7_3 is_a: CHEBI:133575 ! N-acyl-gamma-aminobutyrate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132073 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]glycinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132074 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]alaninate subset: chebi_ph7_3 is_a: CHEBI:176557 ! oxidized N-(fatty acyl)-L-alaninate(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:132075 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutanoate subset: chebi_ph7_3 is_a: CHEBI:133575 ! N-acyl-gamma-aminobutyrate is_a: CHEBI:176568 ! oxidized N-(fatty acyl)-gamma-aminobutyrate(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132076 name: N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]glycinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132077 name: N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]alaninate subset: chebi_ph7_3 is_a: CHEBI:176557 ! oxidized N-(fatty acyl)-L-alaninate(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:132078 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutyrate subset: chebi_ph7_3 is_a: CHEBI:133575 ! N-acyl-gamma-aminobutyrate is_a: CHEBI:176568 ! oxidized N-(fatty acyl)-gamma-aminobutyrate(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132079 name: resolvin D1(1-) subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:132080 name: 8-oxoresolvin D1(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:132081 name: 17-oxoresolvin D1(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:132083 name: 18(S)-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:90825 ! 18-HEPE(1-) [Term] id: CHEBI:132085 name: O(3)-(beta-D-xylosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:132087 name: 15(S)-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:132088 name: O(3)-(beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:13209 name: long-chain fatty acid ethyl ester subset: chebi_ph7_3 is_a: CHEBI:78206 ! fatty acid ethyl ester [Term] id: CHEBI:132090 name: O(3)-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:132091 name: (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:90826 ! (5S)-hydroperoxy-18-hydroxy-EPE(1-) [Term] id: CHEBI:132093 name: O(3)-(beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:132104 name: O(3)-(N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:132105 name: O(3)-(N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:132114 name: UDP-N-acetyl-alpha-D-galactosamine 4-sulfate(3-) subset: chebi_ph7_3 is_a: CHEBI:58188 ! UDP-N-acetyl-D-galactosamine 4-sulfate(3-) [Term] id: CHEBI:132115 name: UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate(4-) subset: chebi_ph7_3 is_a: CHEBI:57806 ! UDP-N-acetyl-D-galactosamine 4,6-bissulfate(4-) [Term] id: CHEBI:132116 name: 2-hydroxyisobutanoyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:132117 name: indolmycenic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132118 name: S-(2-carboxy-2-methylbut-3-en-2-yl)glutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:132120 name: resolvin is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:26191 ! polyol relationship: has_role CHEBI:140399 ! specialised pro-resolving mediator [Term] id: CHEBI:132122 name: S-(2-methyl-1-oxobut-3-en-2-yl)glutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:132123 name: 1,2-benzoquinones subset: chebi_ph7_3 is_a: CHEBI:22729 ! benzoquinones is_a: CHEBI:25622 ! orthoquinones [Term] id: CHEBI:132124 name: 1,4-benzoquinones subset: chebi_ph7_3 is_a: CHEBI:22729 ! benzoquinones is_a: CHEBI:25830 ! p-quinones [Term] id: CHEBI:132125 name: 2,4-didehydro-3-deoxy-L-rhamnonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132127 name: hepoxilin A3(1-) subset: chebi_ph7_3 is_a: CHEBI:62938 ! hepoxilin anion [Term] id: CHEBI:132128 name: (3R)-farnesyl-6-hydroxy-2,3,5-trimethyl-4-oxocyclohexa-1,5-diene-1-carboxylic acid is_a: CHEBI:26660 ! sesterterpenoid is_a: CHEBI:33823 ! enol is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:132129 name: (8S)-hepoxilin A3(1-) subset: chebi_ph7_3 is_a: CHEBI:132127 ! hepoxilin A3(1-) [Term] id: CHEBI:132130 name: hydroxyquinone is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:132131 name: 3,5-dimethylorsellinic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:132137 name: (R)-demethyl-4-deoxygadusol is_a: CHEBI:33573 ! tetrol is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51689 ! enone [Term] id: CHEBI:132139 name: (R)-demethyl-4-deoxygadusol(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:132142 name: 1,4-naphthoquinones is_a: CHEBI:25481 ! naphthoquinone is_a: CHEBI:25830 ! p-quinones [Term] id: CHEBI:132149 name: prostaglandin D3(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:132151 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:132153 name: hyaluronate subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:132154 name: N-acetyl-beta-D-glucosaminyl-(1->4)-[hyaluronate] subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:132155 name: hydroxynaphthoquinone is_a: CHEBI:132130 ! hydroxyquinone is_a: CHEBI:25481 ! naphthoquinone [Term] id: CHEBI:132157 name: hydroxy-1,4-naphthoquinone is_a: CHEBI:132142 ! 1,4-naphthoquinones is_a: CHEBI:132155 ! hydroxynaphthoquinone [Term] id: CHEBI:132174 name: beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59985 ! beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) [Term] id: CHEBI:132177 name: 2-hydroxy-3-methyl-2-butenoic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:132183 name: (3S)-hydroxyadipyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:132188 name: methionine sulfone is_a: CHEBI:25230 ! methionine derivative is_a: CHEBI:35850 ! sulfone is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:132198 name: pentahydroxyanthraquinone is_a: CHEBI:37485 ! hydroxyanthraquinones [Term] id: CHEBI:132200 name: 11(S),15(S)-dihydroxy-14(R)-(S-glutathionyl)-5(Z),8(Z),12(E)-icosatrienoate(2-) subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:132201 name: 11(S)-hydroxy-14(S),15(S)-hepoxilin A3(1-) subset: chebi_ph7_3 is_a: CHEBI:62938 ! hepoxilin anion [Term] id: CHEBI:132202 name: (2R)-CDP-glycerol is_a: CHEBI:17885 ! CDP-glycerol [Term] id: CHEBI:132210 name: N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:60057 ! N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) [Term] id: CHEBI:132211 name: 4-O-[(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:132218 name: 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:90826 ! (5S)-hydroperoxy-18-hydroxy-EPE(1-) [Term] id: CHEBI:132219 name: 5(S),6(S)-epoxy-18(R)-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:133812 ! 5(S),6(S)-epoxy-18-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:132224 name: 4-O-(\{poly[(2R)-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:132228 name: (13S,14S)-epoxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132232 name: ethylenediaminetriacetic acid is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:31577 ! ethylenediamine derivative is_a: CHEBI:60892 ! polyamino carboxylic acid relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132233 name: 1-phenylpropan-2-amine is_a: CHEBI:32877 ! primary amine [Term] id: CHEBI:132240 name: ethylenediaminediacetic acid is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:31577 ! ethylenediamine derivative is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:60892 ! polyamino carboxylic acid relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132244 name: (E)-3-(indol-3-yl)acrylic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:132245 name: (2R,3S)-glycosmisic acid is_a: CHEBI:91209 ! glycosmisic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132246 name: all-trans-3,4-didehydroretinol subset: chebi_ph7_3 is_a: CHEBI:12777 ! vitamin A is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:132247 name: (-)-DCA-CL is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25036 ! lignan is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132248 name: N(4)-(N-acetyl-beta-D-glucosyl)-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:132249 name: (-)-DCA-CC is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:25036 ! lignan is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132250 name: (+)-DCA-CC is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:25036 ! lignan is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132251 name: (+)-DCA-CL is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25036 ! lignan is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:132253 name: 12,18-didecarboxysirohaem is_a: CHEBI:30413 ! heme relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132255 name: N-arachidonoylserotonin subset: chebi_ph7_3 is_a: CHEBI:134175 ! N-acylserotonin is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:64033 ! EC 3.5.1.99 (fatty acid amide hydrolase) inhibitor relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:70774 ! capsaicin receptor antagonist relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:132256 name: N-arachidonoyl-2-oxoserotonin subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:33853 ! phenols is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:132257 name: (2S,3R)-glycosmisic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid is_a: CHEBI:91209 ! glycosmisic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:132258 name: (2E,5E)-tetradecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:132259 name: all-trans-4-hydroxyretinol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132261 name: (1R,5aS,6R)-1,4,5,5a,6,9-hexahydrophenazine-1,6-dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132262 name: (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132263 name: (5aS)-5,5a-dihydrophenazine-1,6-dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132264 name: 5,10-dihydrophenazine-1,6-dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:132265 name: (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1-carboxylic acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132266 name: (10aS)-10,10a-dihydrophenazine-1-carboxylic acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:132269 name: (3E)-octenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:132271 name: (2E,5Z)-octadienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:132274 name: (14S,15R)-EET is_a: CHEBI:34157 ! 14,15-EET [Term] id: CHEBI:132275 name: (14R,15S)-EET is_a: CHEBI:34157 ! 14,15-EET [Term] id: CHEBI:132276 name: (11S,12R)-EET is_a: CHEBI:34130 ! 11,12-EET relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132277 name: (11R,12S)-EET is_a: CHEBI:34130 ! 11,12-EET relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:132278 name: 1-O-[(9S,10R)-epoxystearoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167116 ! oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64561 ! lysophosphatidylcholine 18:0 [Term] id: CHEBI:132280 name: 1-O-[(9R,10S)-epoxystearoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167116 ! oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64561 ! lysophosphatidylcholine 18:0 [Term] id: CHEBI:132285 name: 1-O-(8-hydroxyoleoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167116 ! oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64566 ! lysophosphatidylcholine 18:1 [Term] id: CHEBI:132286 name: 1-O-(11-hydroxyoleoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167116 ! oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64566 ! lysophosphatidylcholine 18:1 [Term] id: CHEBI:132297 name: methamphetamine(1+) subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion [Term] id: CHEBI:132302 name: (8S,9R)-EET is_a: CHEBI:34490 ! 8,9-EET relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:132303 name: (8R,9S)-EET is_a: CHEBI:34490 ! 8,9-EET relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:132306 name: (1R)-1,4,5,10-tetrahydrophenazine-1-carboxylic acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:132309 name: S-butyryl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132310 name: S-acyl-4'-phosphopantetheine is_a: CHEBI:26073 ! phosphopantetheine is_a: CHEBI:51277 ! thioester [Term] id: CHEBI:132311 name: S-hexanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132312 name: S-octanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132313 name: S-decanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132316 name: S-dodecanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132319 name: S-tetradecanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132320 name: S-hexadecanoyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132321 name: S-choloyl-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132322 name: S-(3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl)-4'-phosphopantetheine is_a: CHEBI:132310 ! S-acyl-4'-phosphopantetheine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132323 name: 19-HETrE is_a: CHEBI:72793 ! HETrE is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132324 name: 20-HETrE is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:72793 ! HETrE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132325 name: 21-HDoHE is_a: CHEBI:72790 ! hydroxydocosahexaenoic acid is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132356 name: 4-O-(\{poly[(2R)-2-glucosyl-1-glycerylphosphonato]}-[2R]-1-glycerylphosphonato)-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:132358 name: 1alpha-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid is_a: CHEBI:71017 ! 1-hydroxy steroid [Term] id: CHEBI:132361 name: O-(S-[2S,4S,6S]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:132362 name: citrate(4-) is_a: CHEBI:133748 ! citrate anion [Term] id: CHEBI:132365 name: EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor is_a: CHEBI:76902 ! EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor [Term] id: CHEBI:132367 name: beta-D-glucuronoside(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:132368 name: glucuronate acceptor subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:132415 name: O(3)-(poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:132416 name: O(3)-(N-acetyl-alpha-D-glucosaminyl-poly[(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl]-(1->4)-beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-xylosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:132449 name: wax ester 36:1 subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:132473 name: 13-hydroxytetradecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132474 name: fatty acid-taurine conjugate is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:33551 ! organosulfonic acid [Term] id: CHEBI:132475 name: N-dodecanoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132476 name: N-tetradecanoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132477 name: N-hexadecanoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132479 name: N-stearoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:13248 name: anilide subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:62733 ! aromatic amide [Term] id: CHEBI:132480 name: N-icosanoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132494 name: fatty acid 16:2 is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:132499 name: fatty acid 16:3 is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:132502 name: fatty acid 18:3 is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:132503 name: fatty acid 18:4 is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:132505 name: N-tetracosanoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132506 name: N-arachidonoyltaurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132507 name: N-[12(S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]taurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132508 name: N-[15(S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]taurine is_a: CHEBI:132474 ! fatty acid-taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:132510 name: alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61935 ! alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132511 name: alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61937 ! alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132515 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61942 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132516 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61943 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132517 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61944 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132519 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61945 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132520 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61946 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132521 name: alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61947 ! alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132522 name: alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61948 ! alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132523 name: alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:61949 ! alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) [Term] id: CHEBI:132525 name: oligosaccharide-(1->4)-N-acetyl-beta-D-glucosamine-(1->4)-N-acetyl-alpha-D-glucosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:132529 name: N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:13253 name: Asp-tRNA(Asx) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA [Term] id: CHEBI:132537 name: N(4)-(alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-asparaginyl residue subset: chebi_ph7_3 is_a: CHEBI:192714 ! an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue [Term] id: CHEBI:132538 name: fatty acid 20:1 is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:132539 name: fatty acid 20:4 is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:132540 name: fatty acid 20:5 is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:132541 name: fatty acid 22:1 is_a: CHEBI:25413 ! monounsaturated fatty acid [Term] id: CHEBI:132543 name: fatty acid 22:5 is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:132544 name: fatty acid 22:6 is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:132554 name: oligomer is_a: CHEBI:25367 ! molecule [Term] id: CHEBI:132569 name: O-(S-[2R,4R,6R,8R]-2,4,6,8-tetramethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:132570 name: O-(S-[2R,4R,6R]-2,4,6-trimethyl-very-long-chain fatty acyl-pantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64479 ! O-(pantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:132610 name: phthalic acid monoester is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:35484 ! phthalate ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:132623 name: nodakenetin subset: chebi_ph7_3 is_a: CHEBI:49080 ! marmesin relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:132671 name: (12S)-hydroperoxy-(14R,15S)-epoxy-(5Z,8Z,10E)-icosatrienoic acid is_a: CHEBI:134641 ! hydroperoxy(epoxy)icosatrienoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132678 name: 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132681 name: (12S)-hydroperoxy-(14S,15R)-epoxy-(5Z,8Z,10E)-icosatrienoic acid is_a: CHEBI:134641 ! hydroperoxy(epoxy)icosatrienoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132683 name: (5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid is_a: CHEBI:134641 ! hydroperoxy(epoxy)icosatrienoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132708 name: N-arachidonoyl-L-alanine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:83946 ! N-acyl-L-alanine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132717 name: bleaching agent is_a: CHEBI:33893 ! reagent [Term] id: CHEBI:132722 name: N-arachidonoyl-gamma-aminobutyric acid is_a: CHEBI:134018 ! N-acyl-gamma-aminobutyric acid is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132725 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]glycine is_a: CHEBI:156403 ! hydroperoxy fatty amide is_a: CHEBI:16180 ! N-acylglycine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132727 name: 11a-hydroxytetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:144645 ! an 11a-hydroxytetracyline zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:132734 name: 6-methylpretetramide(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:132735 name: 4-hydroxy-6-methylpretetramide(1-) is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:132736 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]alanine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:156403 ! hydroperoxy fatty amide is_a: CHEBI:83946 ! N-acyl-L-alanine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132737 name: 4-de(dimethylamino)-4-oxoanhydrotetracycline(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:132738 name: N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]glycine is_a: CHEBI:156403 ! hydroperoxy fatty amide is_a: CHEBI:16180 ! N-acylglycine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132740 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutanoic acid is_a: CHEBI:134018 ! N-acyl-gamma-aminobutyric acid is_a: CHEBI:156403 ! hydroperoxy fatty amide relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132742 name: lysophosphatidic acid is_a: CHEBI:32957 ! lysophosphatidic acids [Term] id: CHEBI:132746 name: N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]alanine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:156403 ! hydroperoxy fatty amide is_a: CHEBI:83946 ! N-acyl-L-alanine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132747 name: N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutyric acid is_a: CHEBI:134018 ! N-acyl-gamma-aminobutyric acid is_a: CHEBI:156403 ! hydroperoxy fatty amide relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:132749 name: (S)-nandinine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:74518 ! anti-obesity agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:132750 name: 2-methylbutan-2-ol subset: chebi_ph7_3 is_a: CHEBI:2571 ! aliphatic alcohol is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:132752 name: 3-hydroxy-3-methylbut-1-ene subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:132797 name: 8-oxoresolvin D1 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:23824 ! diol is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132800 name: 17-oxoresolvin D1 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:23824 ! diol is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132801 name: 18(S)-HEPE is_a: CHEBI:72802 ! 18-HEPE relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:132802 name: (5S)-hydroperoxy-(18S)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid is_a: CHEBI:91287 ! (5S)-hydroperoxy-18-hydroxy-EPE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:132803 name: UDP-N-acetyl-alpha-D-galactosamine 4,6-bissulfate is_a: CHEBI:16544 ! UDP-N-acetyl-D-galactosamine 4,6-bissulfate [Term] id: CHEBI:132804 name: UDP-N-acetyl-alpha-D-galactosamine 4-sulfate is_a: CHEBI:17550 ! UDP-N-acetyl-D-galactosamine 4-sulfate [Term] id: CHEBI:132805 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:63436 ! carbohydrate acid derivative is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:132808 name: (8S)-hydroperoxy-(14S,15R)-epoxy-(5Z,9E,11Z)-icosatrienoic acid is_a: CHEBI:134641 ! hydroperoxy(epoxy)icosatrienoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132809 name: (8S)-hepoxilin A3 is_a: CHEBI:36190 ! hepoxilin A3 [Term] id: CHEBI:132814 name: beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:59412 ! amino tetrasaccharide [Term] id: CHEBI:132818 name: apigenin 7-O-beta-L-glucoside is_a: CHEBI:38686 ! dihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:75759 ! beta-L-glucoside [Term] id: CHEBI:132832 name: (+)-alpha-gurjunene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:132875 name: N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:16073 ! N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate [Term] id: CHEBI:132876 name: beta-D-glucosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:15696 ! beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate [Term] id: CHEBI:132877 name: 4-O-[(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:132883 name: 11(S),15(S)-dihydroxy-14(R)-(S-glutathionyl)-5(Z),8(Z),12(E)-icosatrienoic acid is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:61697 ! fatty acid derivative relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132886 name: 11(S)-hydroxy-14(S),15(S)-hepoxilin A3 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:36200 ! hepoxilin is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:132906 name: (-)-Tau-muurolol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:22975 ! cadinane sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:24127 ! fungicide relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:132908 name: 5(S)-hydroperoxy-18(R)-hydroxy-(6E,8Z,11Z,14Z,16E)-icosapentaenoic acid is_a: CHEBI:91287 ! (5S)-hydroperoxy-18-hydroxy-EPE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:132909 name: 5(S),6(S)-epoxy-18(R)-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:132917 name: 2-isopropylmalate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132924 name: sulfoglycolithocholate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:132938 name: ethylmalonate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132939 name: ethylmalonate(2-) subset: chebi_ph7_3 is_a: CHEBI:132938 ! ethylmalonate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:132940 name: 1,3,7-trimethylurate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:132941 name: 2-hydroxyglutarate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132942 name: quinolinate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132943 name: aspartate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132944 name: octadec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:78049 ! octadecenoate [Term] id: CHEBI:132946 name: (R)-2-hydroxyglutaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:78628 ! 2-hydroxyglutaryl-CoA(5-) [Term] id: CHEBI:132948 name: pyridoxate is_a: CHEBI:38181 ! pyridinemonocarboxylate [Term] id: CHEBI:132950 name: tartrate is_a: CHEBI:33798 ! tetraric acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132951 name: maleate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132952 name: oxalate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132953 name: suberate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132954 name: sebacate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132955 name: azelaate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:132957 name: N-acetylmethioninate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:132958 name: N-acetylmethionine is_a: CHEBI:25230 ! methionine derivative is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:51569 ! N-acyl-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:132960 name: 3-phosphoglycerate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:132966 name: hippurates is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:132970 name: 5-ammoniolevulinic acid is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:132977 name: 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:132978 name: 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:132987 name: alliin zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77307 ! cardioprotective agent [Term] id: CHEBI:132988 name: bradykinin(2+) subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:132989 name: O-acetylhomoserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:132992 name: radiosensitizing agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:133000 name: pregnenolone sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167108 ! pregnane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:133004 name: bisbenzylisoquinoline alkaloid is_a: CHEBI:22750 ! benzylisoquinoline alkaloid [Term] id: CHEBI:133011 name: oxytetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:144644 ! a tetracycline zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:133012 name: 5a,11a-dehydrooxytetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:133029 name: S-octanoyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:133039 name: 1-(2-aminophenyl)decane-1,3-dione subset: chebi_ph7_3 is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:133041 name: L-leucyl-L-glutamyl zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:133042 name: L-leucyl-L-aspartyl zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:133043 name: L-leucyl-L-lysyl(2+) group subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133044 name: L-leucyl-L-arginyl(2+) group subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133045 name: L-methionyl-L-aspartyl zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:133050 name: N-tetradecanoylglycyl group subset: chebi_ph7_3 is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:133063 name: N(alpha)-acetyl-L-methionyl-L-aspartyl(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:133084 name: prostaglandin G1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:133103 name: (3alpha,5alpha,17beta)-3-hydroxyandrostan-17-yl sulfate is_a: CHEBI:131647 ! androstane sulfate is_a: CHEBI:36835 ! 3alpha-hydroxy steroid [Term] id: CHEBI:133105 name: (3alpha,5alpha,17beta)-3-hydroxyandrostan-17-yl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:133131 name: spiro-epoxide is_a: CHEBI:32955 ! epoxide is_a: CHEBI:37948 ! oxaspiro compound [Term] id: CHEBI:133132 name: prostaglandin E3(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133133 name: prostaglandin G3(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133134 name: prostaglandin H3(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133135 name: chromenochromene is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:133172 name: 2-hydroxydecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:133174 name: 2-hydroxydecanoate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:133220 name: tuberonic acid is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:36140 ! cyclopentanones relationship: has_role CHEBI:24937 ! jasmonates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133221 name: 2-oxindole-3-acetic acid is_a: CHEBI:24803 ! indole-3-acetic acids is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38459 ! oxindoles relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133241 name: omega-carboxyacyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:133242 name: O-[S-(medium-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133243 name: O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133245 name: quercetin 3,7-di-O-alpha-L-rhamnoside is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:76424 ! quercetin O-glycoside [Term] id: CHEBI:133249 name: saturated fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:133251 name: 3-hydroxydicarboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133291 name: saturated dicarboxylic acid dianion(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133292 name: 3-oxo fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:133294 name: oxo dicarboxylic acid dianion is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:35903 ! oxo carboxylic acid anion [Term] id: CHEBI:133300 name: O-\{S-[17-(4-hydroxyphenyl)heptadecanoyl]pantetheine-4'-phosphoryl}serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133301 name: O-\{S-[19-(4-hydroxyphenyl)nonadecanoyl]pantetheine-4'-phosphoryl}serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133304 name: S-anthraniloyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:133309 name: 12-dehydro-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:133318 name: hydroxy fatty aldehyde is_a: CHEBI:35746 ! fatty aldehyde is_a: CHEBI:50413 ! hydroxyaldehyde [Term] id: CHEBI:133319 name: 10,11-dihydro-12-oxoleukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:13332 name: GDP-beta-L-fucose is_a: CHEBI:17009 ! GDP-L-fucose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133331 name: metal oxide is_a: CHEBI:24836 ! inorganic oxide [Term] id: CHEBI:133345 name: 10-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:133346 name: 12-oxo-20-hydroxyleukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:133351 name: N-carbamoylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:133356 name: L-methionyl-L-asparaginyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133358 name: N(alpha)-acetyl-L-methionyl-L-asparaginyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133359 name: L-methionyl-L-glutamyl zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:133360 name: N(alpha)-acetyl-L-methionyl-L-glutamyl(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:133361 name: L-methionyl-L-glutaminyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133362 name: N-acetyl-L-methionyl-L-glutaminyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133367 name: resolvin D2(1-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:133369 name: N-acetylglycyl residue subset: chebi_ph7_3 is_a: CHEBI:134472 ! N-acyl-alpha-aminoacyl group [Term] id: CHEBI:133370 name: prostaglandin A2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133371 name: N-acetyl-L-valyl residue subset: chebi_ph7_3 is_a: CHEBI:134472 ! N-acyl-alpha-aminoacyl group [Term] id: CHEBI:133372 name: N-acetyl-L-cysteinyl residue subset: chebi_ph7_3 is_a: CHEBI:134472 ! N-acyl-alpha-aminoacyl group [Term] id: CHEBI:133374 name: 13,14-dihydro-15-keto-PGF2alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133375 name: N-acetyl-L-threonyl residue subset: chebi_ph7_3 is_a: CHEBI:134472 ! N-acyl-alpha-aminoacyl group [Term] id: CHEBI:133377 name: L-methionyl-L-leucyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133378 name: N-acetyl-L-methionyl-L-leucyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133379 name: N-acetyl-L-methionyl-L-isoleucyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133380 name: L-methionyl-L-isoleucyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133381 name: 9,10-epoxy-18-hydroxyoctadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133382 name: N-acetyl-L-methionyl-L-phenylalanyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133383 name: L-methionyl-L-phenylalanyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133384 name: N-acetyl-L-methionyl-L-tyrosyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133385 name: L-methionyl-L-tyrosyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133386 name: N-acetyl-L-methionyl-L-tryptophyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133387 name: L-methionyl-L-tryptophyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133391 name: prostaglandin B2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133392 name: prostaglandin C2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133393 name: prostaglandin B1(1-) subset: chebi_ph7_3 is_a: CHEBI:26335 ! prostaglandins B is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133396 name: prostaglandin J2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133398 name: L-methionyl-L-alanyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133399 name: N-acetyl-L-methionyl-L-alanyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133400 name: N-acetyl-L-methionyl-L-seryl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133401 name: L-methionyl-L-seryl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133402 name: N-acetyl-L-methionyl-L-valyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133403 name: L-methionyl-L-valyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133404 name: N-acetyl-L-methionyl-L-threonyl residue subset: chebi_ph7_3 is_a: CHEBI:25907 ! peptidyl group [Term] id: CHEBI:133405 name: L-methionyl-L-threonyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133406 name: N-acetyl-L-methionyl-L-lysyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133407 name: L-methionyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:133408 name: 13,14-dihydro-15-oxoprostaglandin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133409 name: 15-oxoprostaglandin F2alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133411 name: 13,14-dihydro-15-keto-PGF1alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133414 name: N-acetyl-L-methionyl residue subset: chebi_ph7_3 is_a: CHEBI:78598 ! N-acetylamino-acid residue [Term] id: CHEBI:133415 name: O-(S-malonamoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133417 name: O-[S-(18-carbamoyl-3,5,7,9,11,13,15,17-octaoxooctadecanoyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:133419 name: 2-isobutyrylphloroglucinol subset: chebi_ph7_3 is_a: CHEBI:134316 ! 2-acylphloroglucinol [Term] id: CHEBI:133421 name: prostaglandin F1alpha (1-) subset: chebi_ph7_3 is_a: CHEBI:178049 ! Prostaglandin F1(1-) is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133424 name: 13,14-dihydro-Delta(12)-prostaglandin J2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:133427 name: omega-ammonioaldehyde subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:133442 name: (5R)-5-hydroxy-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:141817 ! 5-hydroxy-L-lysinium residue is_a: CHEBI:58942 ! amino-acid cation residue [Term] id: CHEBI:133443 name: (5R)-5-(beta-D-galactosyloxy)-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:133444 name: 1-O-acylceramide subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:133445 name: saturated fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133446 name: monounsaturated fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133447 name: methyl-branched fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133448 name: oxo-fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133449 name: hydroxy-fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133450 name: (2E)-enoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:133452 name: (5R)-5-[(alpha-D-glucosyl-(1->2)-beta-D-galactosyl)oxy]-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:133455 name: (2E)-dec-2-enal subset: chebi_ph7_3 is_a: CHEBI:61727 ! 2-decenal relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:25491 ! nematicide relationship: has_role CHEBI:72575 ! alarm pheromone [Term] id: CHEBI:133457 name: (3E)-3-nonen-2-one subset: chebi_ph7_3 is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:39276 ! fumigant relationship: has_role CHEBI:76797 ! EC 2.5.1.18 (glutathione transferase) inhibitor [Term] id: CHEBI:13346 name: Glu-tRNA(Glx) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA [Term] id: CHEBI:133470 name: beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:133476 name: hydantoin-5-propionate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:133479 name: S-(long-chain fatty acyl)-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:133490 name: saturated fatty acyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:83622 ! fatty acyl-AMP(1-) [Term] id: CHEBI:133491 name: alpha-D-Gal-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133492 name: polyunsaturated dicarboxylic acid dianion subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133493 name: omega-(methylthio)-2-oxocarboxylate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:133494 name: 2-(omega-methylthio)alkylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133496 name: 3-(omega-methylthio)alkylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133497 name: 3-(2-methylthioethyl)malate(2-) subset: chebi_ph7_3 is_a: CHEBI:133496 ! 3-(omega-methylthio)alkylmalate(2-) [Term] id: CHEBI:133498 name: 2-(omega-methylthio)alkylmaleate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133499 name: 2-(2-methylthio)ethylmaleate(2-) subset: chebi_ph7_3 is_a: CHEBI:133498 ! 2-(omega-methylthio)alkylmaleate(2-) [Term] id: CHEBI:133500 name: 2-(2-methylthio)propylmaleate(2-) subset: chebi_ph7_3 is_a: CHEBI:133498 ! 2-(omega-methylthio)alkylmaleate(2-) [Term] id: CHEBI:133501 name: 3-(3-methylthio)propylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:133496 ! 3-(omega-methylthio)alkylmalate(2-) [Term] id: CHEBI:133506 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:133507 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:133509 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:133510 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:133511 name: 3-hydroxyoctanoate subset: chebi_ph7_3 is_a: CHEBI:133719 ! hydroxyoctanoate is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:133513 name: 3-methylglutaconate anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:133514 name: 2-hydroxyoctanoate subset: chebi_ph7_3 is_a: CHEBI:133719 ! hydroxyoctanoate is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:133517 name: 5alpha-androstane-3alpha,17beta-diol 17-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid [Term] id: CHEBI:133518 name: (E)-3-methylglutaconate anion is_a: CHEBI:133513 ! 3-methylglutaconate anion [Term] id: CHEBI:133519 name: 5alpha-androstane-3alpha,17beta-diol 17-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:133520 name: N-acetyl-L-alaninate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:133525 name: N-acylphytosphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:84404 ! ceramide 1-phosphate(2-) [Term] id: CHEBI:133526 name: oxodocosahexaenoate is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:133538 name: L-lysine zwitterion is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:133539 name: hydroxyicosatrienoate is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:133549 name: N-acetyl-L-threoninate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:133556 name: oxooctadecadienoate subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:133557 name: hydroperoxyoctadecenoate is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:64012 ! hydroperoxy fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:133558 name: hydroperoxyoctadecatrienoate is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133564 name: D-glucosyl salicylate subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35436 ! D-glucoside is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133574 name: 5-hydroxylysinium subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:133575 name: N-acyl-gamma-aminobutyrate subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:133577 name: 2-hydroxy-4-methylvalerate subset: chebi_ph7_3 is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:133585 name: epoxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133586 name: epoxyoctadecenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:133598 name: chlortetracycline(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:133603 name: methanesulfinate subset: chebi_ph7_3 is_a: CHEBI:37785 ! organosulfinate oxoanion [Term] id: CHEBI:133606 name: 1-octadecanoyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:65055 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74240 ! phosphatidylinositol 38:4(1-) is_a: CHEBI:75243 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:133618 name: leukotriene F4(2-) subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion is_a: CHEBI:60334 ! peptide anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:133631 name: 1-palmitoyl-2-icosatrienoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64523 ! phosphatidylcholine 36:3 is_a: CHEBI:77369 ! 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:133652 name: hydroperoxy(epoxy)icosatrienoate is_a: CHEBI:131865 ! EET(1-) is_a: CHEBI:131875 ! hydroperoxyicosatrienoate [Term] id: CHEBI:133653 name: hydroperoxy(hydroxy)icosapentaenoate is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:133654 name: hydroxydocosapentaenoate is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion [Term] id: CHEBI:133661 name: hyocholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:133673 name: glyphosate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133674 name: (aminomethyl)phosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133696 name: desmethylanhydrotetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:133697 name: 4-amino-4-de(dimethylamino)anhydrotetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:133716 name: N-acetyl-L-valinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:133719 name: hydroxyoctanoate is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:133720 name: glycochenodeoxycholic acid sulfate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:133723 name: naphthalene-1,2,4,8-tetrol subset: chebi_ph7_3 is_a: CHEBI:26925 ! naphthalenetetrol is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:133738 name: 2-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:133741 name: (E)-dodec-2-enal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84588 ! trans-2,3-unsaturated fatty aldehyde relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133748 name: citrate anion is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:133752 name: epsilon-(gamma-glutamyl)lysine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:133768 name: (R)-PGA2-S-glutathione conjugate(2-) subset: chebi_ph7_3 is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:133769 name: (S)-PGA2-S-glutathione conjugate(2-) subset: chebi_ph7_3 is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:133771 name: (R)-PGJ2-S-glutathione conjugate(2-) subset: chebi_ph7_3 is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:133772 name: (S)-PGJ2-S-glutathione conjugate(2-) subset: chebi_ph7_3 is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:133773 name: pimelate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:133775 name: dimethylargininium(1+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:133778 name: 1alpha-hydroxyandrost-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid is_a: CHEBI:71017 ! 1-hydroxy steroid [Term] id: CHEBI:133790 name: linolenate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:133791 name: 2-hydroxybutyrates is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:133792 name: erythronate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:133793 name: prostaglandin G1 is_a: CHEBI:194320 ! hydroperoxy monounsaturated fatty acid is_a: CHEBI:26343 ! prostaglandins G is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:133795 name: (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131868 ! hydroperoxydocosahexaenoate [Term] id: CHEBI:133796 name: (4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133797 name: (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133798 name: (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133799 name: (4Z,7Z,10Z,12E,16Z)-14-hydroperoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133812 name: 5(S),6(S)-epoxy-18-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:133819 name: 13-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131861 ! HODE(1-) [Term] id: CHEBI:133820 name: 9-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131861 ! HODE(1-) [Term] id: CHEBI:133860 name: polyunsaturated hydroxylipid subset: chebi_ph7_3 is_a: CHEBI:131727 ! hydroxylipid [Term] id: CHEBI:133867 name: 4-O-[di(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133872 name: (2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid is_a: CHEBI:33823 ! enol is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:133886 name: FMNH2(3-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:13389 name: NAD is_a: CHEBI:25524 ! NAD(P) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:133892 name: 4-O-[1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133894 name: 4-O-[poly(1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:133896 name: 4-O-(\{poly[1-D-ribitylphosphonato]}-di\{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:133897 name: methanesulfinic acid is_a: CHEBI:37783 ! organosulfinic acid [Term] id: CHEBI:133898 name: chromopyrrolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:133899 name: 8(S),15(S)-DiHPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:137544 ! bis(hydroperoxy)icosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:13390 name: NAD(P)(+) is_a: CHEBI:25524 ! NAD(P) [Term] id: CHEBI:133900 name: 14(R),15(S)-DiHPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:137544 ! bis(hydroperoxy)icosatetraenoate [Term] id: CHEBI:133901 name: 3-aminobutyryl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:133902 name: dUMP residue(1-) subset: chebi_ph7_3 is_a: CHEBI:140284 ! deoxyribonucleotide(1-) residue [Term] id: CHEBI:133903 name: 8(S),15(S)-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133910 name: 2-trans-abscisic acid D-glucosyl ester subset: chebi_ph7_3 is_a: CHEBI:24278 ! glucoside is_a: CHEBI:51702 ! enoate ester is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:133911 name: alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61898 ! alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:133912 name: alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61900 ! alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:133917 name: ochratoxin alpha is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33853 ! phenols is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:38758 ! isocoumarins is_a: CHEBI:38762 ! isochromanes relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:13392 name: NAD(P)H is_a: CHEBI:25524 ! NAD(P) [Term] id: CHEBI:133927 name: glycolaldehyde phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:133928 name: 2,5-diiminio-3,4-bis(indol-3-yl)hexanedioate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:133929 name: 3,4-bis(7-chloroindol-3-yl)-2,5-diiminiohexanedioate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:133930 name: 5alpha-androst-1-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:20156 ! 3-oxo-Delta(1) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:133931 name: (4Z,7Z,10Z,13Z,16Z)-19,20-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157773 ! epoxydocosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133932 name: (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157773 ! epoxydocosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133933 name: (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157773 ! epoxydocosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133934 name: (4Z,7Z,13Z,16Z,19Z)-10,11-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157773 ! epoxydocosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133935 name: (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157772 ! epoxydocosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133936 name: (7Z,10Z,13Z,19Z)-16,17-epoxydocosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157772 ! epoxydocosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133937 name: (7Z,10Z,16Z,19Z)-13,14-epoxydocosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157772 ! epoxydocosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133938 name: (7Z,13Z,16Z,19Z)-10,11-epoxydocosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:157772 ! epoxydocosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133939 name: (4Z,7Z,10Z,13Z,16Z)-20-hydroxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:133654 ! hydroxydocosapentaenoate [Term] id: CHEBI:133940 name: lithocholate sulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:133941 name: (3S,5R,10R,12S,14S,15R,16R)-3,5,10,14,15-pentahydroxy-12,16-dimethylicosan-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:37205 ! pentol relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:133948 name: (4Z,7Z,11Z,13Z,15E,17S,19Z)-10,17-bis(hydroperoxy)docosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:133949 name: (4Z,7Z,11Z,13Z,15E,17S)-10,17-bis(hydroperoxy)docosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133950 name: (7Z,11Z,13Z,15E,19Z)-10,17-bis(hydroperoxy)docosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:157771 ! hydroperoxydocosapentaenoate [Term] id: CHEBI:133959 name: 4'-methoxyisoflavones subset: chebi_ph7_3 is_a: CHEBI:38756 ! methoxyisoflavone [Term] id: CHEBI:133968 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(purine-ribonucleotide)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:156461 ! 5'-(N(7)-methyl 5'-triphosphoguanosine)-ribonucleoside(2-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:133969 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:167609 ! 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)(2-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:133970 name: N-retinylidene-N-retinylphosphatidylethanolamine betaine subset: chebi_ph7_3 is_a: CHEBI:35285 ! iminium betaine [Term] id: CHEBI:133972 name: primary nitroalkane subset: chebi_ph7_3 is_a: CHEBI:7587 ! nitroalkane [Term] id: CHEBI:133974 name: 12-oxo-6-trans-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:133975 name: Delta(6)-trans-12-epi-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:133977 name: S-(2,4-dinitrophenyl)glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:133979 name: prostaglandin D2 2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:26337 ! prostaglandins D is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:133980 name: oxidised coenzyme F420-(gamma-Glu)n polyanion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:61469 ! polyanionic polymer relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:133985 name: 13(R)-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:90823 ! 13-HPODE(1-) [Term] id: CHEBI:133986 name: (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:133987 name: (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:133988 name: (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:133989 name: (9Z,11R,12Z,15Z)-11-hydroperoxyoctadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:133990 name: (9S,10E,12Z,14E,16S)-9,16-bis(hydroperoxy)octadecatrienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:133991 name: (9S,10E,12Z,14E,16S)-9,16-bis(hydroperoxy)octadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:133992 name: N-oleoylglycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:133993 name: 4'-O-methylnorbelladine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:133994 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61901 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:133995 name: (4aS,10bR)-noroxomaritidine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:133996 name: (4aR,10bS)-noroxomaritidine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:133998 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61906 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:133999 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61915 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134000 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61919 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134001 name: norbelladine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134002 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61921 ! alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134003 name: alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61925 ! alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134004 name: alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61927 ! alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134005 name: alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc(PP-Dol) is_a: CHEBI:61932 ! alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) [Term] id: CHEBI:134017 name: 11a-hydroxytetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:134018 name: N-acyl-gamma-aminobutyric acid is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:134019 name: hydroperoxy polyunsaturated fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:64012 ! hydroperoxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:134020 name: N-oleoyl-L-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149690 ! N-(fatty acyl)-L-phenylalanine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134021 name: N-oleoyl-L-phenylalanine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:77673 ! N-acyl-L-phenylalanine [Term] id: CHEBI:134022 name: N-arachidonoyl-L-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149690 ! N-(fatty acyl)-L-phenylalanine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134027 name: 1,2-bis(octadec-9-enoyl)phosphatidic acid is_a: CHEBI:134237 ! phosphatidic acid 36:2 relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:134031 name: N-oleoyl-L-serinate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134033 name: N-oleoyl-L-glutaminate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149743 ! N-(fatty acyl)-L-glutamine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134035 name: N-oleoyl-L-leucinate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149740 ! N-(fatty acyl)-L-leucine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134041 name: N-octadecanoylglycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:134042 name: N-[(9Z)-hexadecenoyl]glycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:134043 name: phenylureas is_a: CHEBI:22712 ! benzenes is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:134045 name: polychlorinated dibenzodioxines and related compounds is_a: CHEBI:17792 ! organohalogen compound relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:134051 name: (8R,9E,11Z,14Z)-8-hydroperoxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131875 ! hydroperoxyicosatrienoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:134052 name: (8Z,11Z,14Z)-10-hydroperoxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131875 ! hydroperoxyicosatrienoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:134053 name: (8Z,12E,14Z)-11-hydroperoxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131875 ! hydroperoxyicosatrienoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:134054 name: (5Z,8R,9Z,11Z,14Z)-8,9-epoxyicosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:134055 name: (9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:134056 name: (5Z,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131876 ! hydroperoxyicosapentaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:134057 name: (4Z,7Z,11E,13Z,16Z,19Z)-10-hydroperoxydocosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131868 ! hydroperoxydocosahexaenoate [Term] id: CHEBI:134058 name: N-palmitoyl dopamine subset: chebi_ph7_3 is_a: CHEBI:157740 ! N-(fatty acyl)-dopamine is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:134059 name: N-palmitoylserotonin subset: chebi_ph7_3 is_a: CHEBI:134175 ! N-acylserotonin [Term] id: CHEBI:134064 name: N-oleoylserotonin subset: chebi_ph7_3 is_a: CHEBI:134175 ! N-acylserotonin [Term] id: CHEBI:134065 name: N-stearoylserotonin subset: chebi_ph7_3 is_a: CHEBI:134175 ! N-acylserotonin [Term] id: CHEBI:134066 name: N(6)-(pyridoxal phosphate)-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:33271 ! aldimine is_a: CHEBI:38182 ! monohydroxypyridine [Term] id: CHEBI:134068 name: (1->4)-6-phospho-alpha-D-glucan polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:134072 name: N-hexadecanoyl-1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:134079 name: (5Z,8R,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:134056 ! (5Z,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoate [Term] id: CHEBI:134085 name: 3-hydroxyanthocyanidin cation is_a: CHEBI:16366 ! anthocyanidin cation [Term] id: CHEBI:134086 name: (2R,3R)-flavan-3-ol subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:134087 name: 3-hydroxyanthocyanidin betaine subset: chebi_ph7_3 is_a: CHEBI:47916 ! flavonoid is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:134088 name: (2S,3R)-flavan-3-ol subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:134089 name: (2S,3S)-flavan-3-ol subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:134090 name: N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:134093 name: (acetamidomethyl)phosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:134098 name: (S)-(1-aminoethyl)phosphonate subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:134099 name: [(S)-1-acetamidoethyl]phosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:134102 name: (R)-2-amino-4-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:57563 ! 2-amino-4-oxopentanoic acid zwitterion [Term] id: CHEBI:134103 name: N-arachidonoyl-L-leucinate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149740 ! N-(fatty acyl)-L-leucine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134110 name: (9Z,11S,12Z,15Z)-11-hydroperoxyoctadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:134116 name: alpha-muricholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:134119 name: beta-muricholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:134121 name: N-oleoyl-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:149741 ! N-(fatty acyl)-L-isoleucine(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134122 name: N-oleoyl-L-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:134125 name: (R)-NADHX is_a: CHEBI:26916 ! tetrahydronicotinamide adenine dinucleotide is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:134127 name: 1-acylglycerol 16:0 subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride [Term] id: CHEBI:134129 name: 1-acylglycerol 18:0 subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87255 ! monoacylglycerol 18:0 [Term] id: CHEBI:134130 name: 1-acylglycerol 18:1 subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87256 ! monoacylglycerol 18:1 [Term] id: CHEBI:134131 name: 1-acylglycerol 18:2 subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87257 ! monoacylglycerol 18:2 [Term] id: CHEBI:134133 name: 1-acylglycerol 20:4 subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride [Term] id: CHEBI:134138 name: 2-acylglycerol 16:0 subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:87251 ! monoacylglycerol 16:0 [Term] id: CHEBI:134140 name: 2-acylglycerol 18:0 subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:87255 ! monoacylglycerol 18:0 [Term] id: CHEBI:134141 name: 2-acylglycerol 18:1 subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:87256 ! monoacylglycerol 18:1 [Term] id: CHEBI:134142 name: 2-acylglycerol 18:2 subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:87257 ! monoacylglycerol 18:2 [Term] id: CHEBI:134144 name: 2-acylglycerol 20:4 subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride [Term] id: CHEBI:134150 name: N-acylglycine 16:1 is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:134151 name: N-acylglycine 18:0 is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:134152 name: N-acylglycine 18:1 is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:134156 name: N-acylethanolamine 16:1 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85282 ! N-(monounsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134157 name: N-acylethanolamine 18:0 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:134158 name: N-acylethanolamine 18:1 subset: chebi_ph7_3 is_a: CHEBI:85282 ! N-(monounsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134159 name: N-acylethanolamine 18:2 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134161 name: N-acylethanolamine 20:4 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134162 name: N-acylethanolamine 20:5 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134165 name: N-acylethanolamine 22:6 subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine [Term] id: CHEBI:134175 name: N-acylserotonin subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:134176 name: 2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:134178 name: all-trans-4-hydroxyretinoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:134179 name: volatile organic compound is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:134185 name: (S)-all-trans-4-hydroxyretinoate subset: chebi_ph7_3 is_a: CHEBI:134178 ! all-trans-4-hydroxyretinoate [Term] id: CHEBI:134186 name: all-trans-4-oxoretinoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:134191 name: 20-oxo-5-O-beta-mycaminosyltylactone is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134196 name: (2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid is_a: CHEBI:52564 ! 2-carboxy-4-methyl-5-[(2-phosphonooxy)ethylidene]-2,5-dihydrothiazole relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134197 name: 3',5'-cyclic IMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:134198 name: (R)-tembetarine subset: chebi_ph7_3 is_a: CHEBI:136682 ! tembetarine [Term] id: CHEBI:134199 name: (S)-tembetarine subset: chebi_ph7_3 is_a: CHEBI:136682 ! tembetarine is_a: CHEBI:22750 ! benzylisoquinoline alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:134205 name: 2-methyl-D-serine is_a: CHEBI:134206 ! 2-methylserine [Term] id: CHEBI:134206 name: 2-methylserine is_a: CHEBI:24662 ! hydroxy-amino acid [Term] id: CHEBI:134207 name: methylcytosine is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:134208 name: N-acetyl-alpha-D-glucosaminyl-L-tyrosyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:134209 name: aporphine alkaloid is_a: CHEBI:22750 ! benzylisoquinoline alkaloid [Term] id: CHEBI:134210 name: (R)-laudanosine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134211 name: (R)-tetrahydropapaverine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134212 name: (S)-glaucine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134213 name: (S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) subset: chebi_ph7_3 is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:134214 name: L-xylo-3-hexulose subset: chebi_ph7_3 is_a: CHEBI:24973 ! ketohexose [Term] id: CHEBI:134215 name: bulbocapnine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134216 name: muricholic acids is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:27114 ! trihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36844 ! 7-hydroxy steroid is_a: CHEBI:36849 ! 6-hydroxy steroid [Term] id: CHEBI:134217 name: N-methylbulbocapnine(1+) subset: chebi_ph7_3 is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:134219 name: decenals is_a: CHEBI:142621 ! medium-chain fatty aldehyde is_a: CHEBI:61870 ! monounsaturated fatty aldehyde is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:134225 name: 1,4-benzosemiquinones subset: chebi_ph7_3 is_a: CHEBI:22730 ! benzosemiquinones [Term] id: CHEBI:134233 name: (4S)-4,16-dihydroxyretinoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:134237 name: phosphatidic acid 36:2 is_a: CHEBI:16337 ! phosphatidic acid [Term] id: CHEBI:134246 name: (R)-2-hydroxyglutaryl-CoA is_a: CHEBI:28578 ! 2-hydroxyglutaryl-CoA relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:134247 name: (11R)-11-hydroperoxylinoleic acid is_a: CHEBI:78013 ! linoleic acid hydroperoxide [Term] id: CHEBI:134248 name: (11R)-11-hydroperoxylinoleate subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) [Term] id: CHEBI:134249 name: alkanesulfonate oxoanion subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:134251 name: guaiacols subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:134256 name: lipid A (E. coli) is_a: CHEBI:47040 ! lipid A is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:134257 name: lipid A(4-) (E. coli) subset: chebi_ph7_3 is_a: CHEBI:193141 ! a lipid A(4-) is_a: CHEBI:58712 ! lipid A(4-) [Term] id: CHEBI:134258 name: beta-L-Ara4N-lipid A (E. coli) is_a: CHEBI:47763 ! beta-L-Ara4N-lipid A is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:134259 name: beta-L-Ara4N-lipid A(2-) (E. coli) subset: chebi_ph7_3 is_a: CHEBI:58714 ! beta-L-Ara4N-lipid A(2-) [Term] id: CHEBI:134268 name: (S)-mandelamide subset: chebi_ph7_3 is_a: CHEBI:136824 ! mandelamide [Term] id: CHEBI:134269 name: 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:64672 ! differentiation-inducing factor relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:134275 name: keto-L-tagatose subset: chebi_ph7_3 is_a: CHEBI:37462 ! L-tagatose relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:134278 name: S-adenosyl-S-carboxymethyl-L-homocysteine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35282 ! sulfonium betaine is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:134283 name: keto-D-tagatose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:134284 name: keto-L-tagatose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:134286 name: O-succinyl-L-serine is_a: CHEBI:138979 ! hemisuccinate is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:137566 ! EC 2.5.1.48 (cystathionine gamma-synthase) inhibitor [Term] id: CHEBI:134289 name: xanthohumol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134298 name: phosphatidylcholine 12:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:134299 name: phosphatidylcholine 13:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:134302 name: desmethylxanthohumol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134308 name: xanthogalenol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134309 name: 4'-O-methylxanthohumol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134311 name: D-altritol subset: chebi_ph7_3 is_a: CHEBI:24583 ! hexitol relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:134316 name: 2-acylphloroglucinol is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:134326 name: 2-(2-methylbutanoyl)phloroglucinol subset: chebi_ph7_3 is_a: CHEBI:134316 ! 2-acylphloroglucinol [Term] id: CHEBI:134339 name: 2-acyl-4-prenylphloroglucinol is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:134340 name: 2-(2-methylbutanoyl)-4-prenylphloroglucinol subset: chebi_ph7_3 is_a: CHEBI:134339 ! 2-acyl-4-prenylphloroglucinol [Term] id: CHEBI:134341 name: 2-(3-methylbutanoyl)-4-prenylphloroglucinol subset: chebi_ph7_3 is_a: CHEBI:134339 ! 2-acyl-4-prenylphloroglucinol is_a: CHEBI:22707 ! benzenetriol [Term] id: CHEBI:134342 name: 2-isobutyryl-4-prenylphloroglucinol subset: chebi_ph7_3 is_a: CHEBI:134339 ! 2-acyl-4-prenylphloroglucinol is_a: CHEBI:22707 ! benzenetriol [Term] id: CHEBI:134343 name: lupulone(1-) subset: chebi_ph7_3 is_a: CHEBI:134348 ! beta-bitter acid(1-) [Term] id: CHEBI:134344 name: ergothioneine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:134345 name: deoxyhumulone subset: chebi_ph7_3 is_a: CHEBI:136850 ! 2-acyl-4,6-diprenylphloroglucinol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:134346 name: 2-acyl-4,6-diprenylphloroglucinol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134347 name: glandicoline B subset: chebi_ph7_3 is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:24995 ! lactam is_a: CHEBI:33823 ! enol is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:134348 name: beta-bitter acid(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:134349 name: colupulone(1-) subset: chebi_ph7_3 is_a: CHEBI:134348 ! beta-bitter acid(1-) [Term] id: CHEBI:134350 name: lipid A 4'-(2-aminoethyl diphosphate) oxoanion subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:134351 name: lipid A 1-(2-aminoethyl diphosphate) oxoanion subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:134352 name: adlupulone(1-) subset: chebi_ph7_3 is_a: CHEBI:134348 ! beta-bitter acid(1-) [Term] id: CHEBI:134353 name: deoxycohumulone subset: chebi_ph7_3 is_a: CHEBI:136850 ! 2-acyl-4,6-diprenylphloroglucinol relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:33286 ! agrochemical [Term] id: CHEBI:134354 name: deoxyadlupulone subset: chebi_ph7_3 is_a: CHEBI:136850 ! 2-acyl-4,6-diprenylphloroglucinol [Term] id: CHEBI:134356 name: 8-methylmenaquinone-6 subset: chebi_ph7_3 is_a: CHEBI:142110 ! 8-methylmenaquinone is_a: CHEBI:25185 ! menaquinones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134357 name: 8-methylmenaquinol-6 subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:51475 ! naphthohydroquinone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134358 name: 8-geranylumbelliferone subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:134359 name: 8-geranylesculetin subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:37912 ! hydroxycoumarin [Term] id: CHEBI:134361 name: allylic alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:134362 name: homoallylic alcohol subset: chebi_ph7_3 is_a: CHEBI:2571 ! aliphatic alcohol is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:134363 name: tertiary amine oxide is_a: CHEBI:35580 ! N-oxide [Term] id: CHEBI:134364 name: 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:134366 name: 12alpha-hydroxy-3-oxochola-4,6-dien-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:134367 name: 2-bromocarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:134368 name: 5a,11a-dehydrooxytetracycline is_a: CHEBI:26895 ! tetracyclines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134371 name: 2-acyl-4-prenylphloroglucinol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134386 name: 2-acylphloroglucinol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134389 name: beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:134390 name: beta-D-Delta(4)-GlcpA-(1->4)-beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-D-Glcp(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:134391 name: 3,4,6-trichlorocatechol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:134394 name: primary allylic alcohol subset: chebi_ph7_3 is_a: CHEBI:134361 ! allylic alcohol is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:134396 name: secondary allylic alcohol subset: chebi_ph7_3 is_a: CHEBI:134361 ! allylic alcohol is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:134397 name: tertiary allylic alcohol subset: chebi_ph7_3 is_a: CHEBI:134361 ! allylic alcohol is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:134398 name: D-proline betaine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine [Term] id: CHEBI:134399 name: ADP-5-ethyl-4-methylthiazole-2-carboxylic acid is_a: CHEBI:48652 ! 1,3-thiazolemonocarboxylic acid [Term] id: CHEBI:134400 name: cationic peptidyl group is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:134405 name: S-anthraniloyl-L-cysteine is_a: CHEBI:51277 ! thioester is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:134406 name: prostaglandin G3 is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:26343 ! prostaglandins G is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:134407 name: prostaglandin H3 is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:134408 name: N-acetylcadaverine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:134409 name: N(alpha)-acetyl-L-methionyl-L-asparagine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134412 name: 10-formyltetrahydrofolyl-(Glu)n is_a: CHEBI:26908 ! tetrahydrofolyl glutamate [Term] id: CHEBI:134413 name: 10-formyltetrahydrofolyl-(Glu)n polyanion subset: chebi_ph7_3 is_a: CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:134414 name: 2-hydroxyhexacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:134416 name: 3-oxo fatty acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:134417 name: 10,11-dihydro-12-oxoleukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59644 ! oxo fatty acid is_a: CHEBI:61703 ! nonclassic icosanoid [Term] id: CHEBI:134453 name: 10-HETE is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:134456 name: 12-oxo-20-hydroxyleukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:134464 name: [(2->6)-beta-D-fructofuranosyl-]n alpha-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:71296 ! fructan derivative [Term] id: CHEBI:134467 name: L-vinylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:134471 name: N-acetyl-L-methionyl-L-glutamine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134472 name: N-acyl-alpha-aminoacyl group is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:134477 name: N-acetyl-L-methionyl-L-leucine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134478 name: N-acetyl-L-methionyl-L-isoleucine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134481 name: N-acetyl-L-methionyl-L-phenylalanine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134482 name: N-acetyl-L-methionyl-L-tyrosine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134484 name: N-acetyl-L-methionyl-L-tryptophan is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134489 name: N-acetyl-L-methionyl-L-alanine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134491 name: N-acetyl-L-methionyl-L-serine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134492 name: N-acetyl-L-methionyl-L-valine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134495 name: N-acetyl-L-methionyl-L-threonine is_a: CHEBI:27856 ! acetamide is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:134499 name: 13,14-dihydro-15-oxoprostaglandin E1 is_a: CHEBI:26338 ! prostaglandins E relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:134509 name: 13,14-dihydro-15-keto-PGF1alpha is_a: CHEBI:17087 ! ketone is_a: CHEBI:23824 ! diol is_a: CHEBI:36066 ! prostaglandins Falpha [Term] id: CHEBI:134526 name: S-(long-chain fatty acyl)-L-cysteine is_a: CHEBI:51277 ! thioester is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:134527 name: alpha-D-Gal-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:134529 name: omega-(methylthio)-2-oxocarboxylic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:134530 name: 2-(omega-methylthio)alkylmalic acid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:134531 name: polyunsaturated dicarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:134532 name: 3-(omega-methylthio)alkylmalic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:134533 name: 3-(2-methylthioethyl)malic acid is_a: CHEBI:134532 ! 3-(omega-methylthio)alkylmalic acid [Term] id: CHEBI:134534 name: 2-(omega-methylthio)alkylmaleic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:134535 name: 2-(2-methylthio)ethylmaleic acid is_a: CHEBI:134534 ! 2-(omega-methylthio)alkylmaleic acid [Term] id: CHEBI:134536 name: 2-(2-methylthiopropyl)maleic acid is_a: CHEBI:134534 ! 2-(omega-methylthio)alkylmaleic acid [Term] id: CHEBI:134537 name: 3-(3-methylthio)propylmalic acid is_a: CHEBI:134532 ! 3-(omega-methylthio)alkylmalic acid [Term] id: CHEBI:134540 name: N-acylphytosphingosine 1-phosphate is_a: CHEBI:13956 ! ceramide 1-phosphate [Term] id: CHEBI:134542 name: oxodocosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:134567 name: diacylglycerol (18:1/0:0/18:1) subset: chebi_ph7_3 is_a: CHEBI:47777 ! 1,3-diglyceride is_a: CHEBI:85701 ! diacylglycerol 36:2 relationship: has_role CHEBI:137684 ! Papio hamadryas metabolite [Term] id: CHEBI:134582 name: (4S)-4,16-dihydroxyretinoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26537 ! retinoid [Term] id: CHEBI:134607 name: beta-dihydromenaquinone-9 subset: chebi_ph7_3 is_a: CHEBI:25185 ! menaquinones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:134610 name: N-[(2S)-2-amino-2-carboxyethyl]-L-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:134613 name: hydroperoxyoctadecenoic acid is_a: CHEBI:194320 ! hydroperoxy monounsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid [Term] id: CHEBI:134615 name: hydroperoxyoctadecatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:134616 name: 2-(glutathion-S-yl)-1,4-hydroquinone(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:134617 name: epoxystearic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:134621 name: N-[omega-(linoleoyloxy)]acyl-beta-D-glucosyl-(1<->1)-sphingosine subset: chebi_ph7_3 is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:134624 name: N-[omega-(9R)-hydroperoxy-(10E,12Z)-octadecadienoyloxy]acyl-beta-D-glucosyl-(1<->1)-sphingosine subset: chebi_ph7_3 is_a: CHEBI:176642 ! oxidized ceramide is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:134626 name: N-[omega-(9R,10R)-epoxy-(13R)-hydroxy-(11E)-octadecenoyloxy]acyl-beta-D-glucosyl-(1<->1)-sphingosine subset: chebi_ph7_3 is_a: CHEBI:176642 ! oxidized ceramide is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:134628 name: (1E,2S)-2-methylbutanal oxime subset: chebi_ph7_3 is_a: CHEBI:61135 ! (E)-2-methylbutanal oxime [Term] id: CHEBI:134629 name: (1Z,2S)-2-methylbutanal oxime subset: chebi_ph7_3 is_a: CHEBI:61136 ! (Z)-2-methylbutanal oxime [Term] id: CHEBI:134630 name: (2S)-2-methylbutanenitrile subset: chebi_ph7_3 is_a: CHEBI:61669 ! 2-methylbutanenitrile [Term] id: CHEBI:134631 name: L-polyhomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:134632 name: L-dihomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:134631 ! L-polyhomomethionine zwitterion is_a: CHEBI:58832 ! dihomomethionine zwitterion [Term] id: CHEBI:134633 name: L-trihomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:134631 ! L-polyhomomethionine zwitterion is_a: CHEBI:58833 ! trihomomethionine zwitterion [Term] id: CHEBI:134634 name: L-tetrahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:134631 ! L-polyhomomethionine zwitterion is_a: CHEBI:58834 ! tetrahomomethionine zwitterion [Term] id: CHEBI:134635 name: L-pentahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:134631 ! L-polyhomomethionine zwitterion is_a: CHEBI:58835 ! pentahomomethionine zwitterion [Term] id: CHEBI:134636 name: L-hexahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:134631 ! L-polyhomomethionine zwitterion is_a: CHEBI:58836 ! hexahomomethionine zwitterion [Term] id: CHEBI:134641 name: hydroperoxy(epoxy)icosatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:134645 name: hydroperoxy(hydroxy)icosapentaenoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:134651 name: hydroxydocosapentaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:134655 name: desmethylanhydrotetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:134660 name: N-hydroxy-L-polyhomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:134661 name: 5(S),6(S)-epoxy-18(S)-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:133812 ! 5(S),6(S)-epoxy-18-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoate [Term] id: CHEBI:134663 name: N,N-dihydroxy-L-polyhomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:134664 name: N-hydroxy-L-dihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134660 ! N-hydroxy-L-polyhomomethioninate is_a: CHEBI:58840 ! N-hydroxydihomomethioninate [Term] id: CHEBI:134665 name: N,N-dihydroxy-L-dihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134663 ! N,N-dihydroxy-L-polyhomomethioninate is_a: CHEBI:58846 ! N,N-dihydroxydihomomethioninate [Term] id: CHEBI:134666 name: N-hydroxy-L-trihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134660 ! N-hydroxy-L-polyhomomethioninate is_a: CHEBI:58841 ! N-hydroxytrihomomethioninate [Term] id: CHEBI:134667 name: N,N-dihydroxy-L-trihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134663 ! N,N-dihydroxy-L-polyhomomethioninate is_a: CHEBI:58847 ! N,N-dihydroxytrihomomethioninate [Term] id: CHEBI:134668 name: N-hydroxy-L-tetrahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134660 ! N-hydroxy-L-polyhomomethioninate is_a: CHEBI:58842 ! N-hydroxytetrahomomethioninate [Term] id: CHEBI:134669 name: N,N-dihydroxy-L-tetrahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134663 ! N,N-dihydroxy-L-polyhomomethioninate is_a: CHEBI:58848 ! N,N-dihydroxytetrahomomethioninate [Term] id: CHEBI:134670 name: N-hydroxy-L-pentahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134660 ! N-hydroxy-L-polyhomomethioninate is_a: CHEBI:58843 ! N-hydroxypentahomomethioninate [Term] id: CHEBI:134671 name: N,N-dihydroxy-L-pentahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134663 ! N,N-dihydroxy-L-polyhomomethioninate is_a: CHEBI:58849 ! N,N-dihydroxypentahomomethioninate [Term] id: CHEBI:134672 name: N-hydroxy-L-hexahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134660 ! N-hydroxy-L-polyhomomethioninate is_a: CHEBI:58844 ! N-hydroxyhexahomomethioninate [Term] id: CHEBI:134673 name: N,N-dihydroxy-L-hexahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:134663 ! N,N-dihydroxy-L-polyhomomethioninate is_a: CHEBI:58845 ! N,N-dihydroxyhexahomomethioninate [Term] id: CHEBI:134680 name: omega-(methylsulfanyl)-(E)-alkanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:134681 name: (E)-6-(methylsulfanyl)hexanal oxime subset: chebi_ph7_3 is_a: CHEBI:134680 ! omega-(methylsulfanyl)-(E)-alkanal oxime is_a: CHEBI:50701 ! 6-(methylsulfanyl)hexanal oxime [Term] id: CHEBI:134682 name: (E)-5-(methylsulfanyl)pentanal oxime subset: chebi_ph7_3 is_a: CHEBI:134680 ! omega-(methylsulfanyl)-(E)-alkanal oxime is_a: CHEBI:50700 ! 5-(methylsulfanyl)pentanal oxime [Term] id: CHEBI:134683 name: (E)-7-(methylsulfanyl)heptanal oxime subset: chebi_ph7_3 is_a: CHEBI:134680 ! omega-(methylsulfanyl)-(E)-alkanal oxime is_a: CHEBI:50702 ! 7-(methylsulfanyl)heptanal oxime [Term] id: CHEBI:134684 name: (E)-8-(methylsulfanyl)octanal oxime subset: chebi_ph7_3 is_a: CHEBI:134680 ! omega-(methylsulfanyl)-(E)-alkanal oxime is_a: CHEBI:50703 ! 8-(methylsulfanyl)octanal oxime [Term] id: CHEBI:134685 name: (E)-9-(methylsulfanyl)nonanal oxime subset: chebi_ph7_3 is_a: CHEBI:134680 ! omega-(methylsulfanyl)-(E)-alkanal oxime is_a: CHEBI:50704 ! 9-(methylsulfanyl)nonanal oxime [Term] id: CHEBI:13488 name: UDP-D-galacturonic acid is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:13497 name: UDP-alpha-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:13534 name: acyl-carrier protein is_a: CHEBI:36080 ! protein relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:135511 name: rebeccamycin subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:51914 ! organic heterohexacyclic compound is_a: CHEBI:51915 ! indolocarbazole [Term] id: CHEBI:136009 name: (6S)-5-methyltetrahydrofolic acid is_a: CHEBI:15641 ! 5-methyltetrahydrofolic acid [Term] id: CHEBI:13601 name: 3-oxo-5alpha-steroid subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:136061 name: (E)-1-(glutathione-S-yl)-omega-(methylthio)alkylhydroximate(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:136065 name: 1-aci-nitro-omega-(methylsulfanyl)alkane subset: chebi_ph7_3 is_a: CHEBI:136622 ! aci-nitro compound is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:136067 name: 3-aci-nitropropanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136078 name: 4-O-[di(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:13610 name: 3beta-hydroxysterol ester subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:136105 name: (R)-PGA2-S-glutathione conjugate is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:136106 name: (S)-PGA2-S-glutathione conjugate is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:136107 name: 8,9-epoxy-(5Z,11Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176588 ! oxidized icosatrienoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:13611 name: 4-hydroxy carboxylic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid [Term] id: CHEBI:136110 name: (R)-PGJ2-S-glutathione conjugate is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:136112 name: (S)-PGJ2-S-glutathione conjugate is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:136113 name: (4Z,7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:136115 name: 11,12-epoxy-(5Z,8Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176588 ! oxidized icosatrienoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136117 name: 14,15-epoxy-(5Z,8Z,11Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176588 ! oxidized icosatrienoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136118 name: (4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid [Term] id: CHEBI:13614 name: 6,7-dihydropteridines subset: chebi_ph7_3 is_a: CHEBI:26373 ! pteridines [Term] id: CHEBI:136179 name: (+)-7-isojasmonate subset: chebi_ph7_3 is_a: CHEBI:136184 ! jasmonic acid anion is_a: CHEBI:167055 ! Jasmonate derivatives [Term] id: CHEBI:136180 name: N-[(+)-7-isojasmonyl]-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:136183 ! N-jasmonyl-L-alpha-amino acid anion is_a: CHEBI:138627 ! N-[(3R)-jasmonyl]-L-isoleucinate [Term] id: CHEBI:136181 name: N-[(+)-12-hydroxy-7-isojasmonyl]-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:138626 ! N-[(3R)-12-hydroxyjasmonyl]-L-isoleucinate [Term] id: CHEBI:136182 name: tuberonate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:136183 name: N-jasmonyl-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:136184 name: jasmonic acid anion subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion relationship: has_role CHEBI:24937 ! jasmonates [Term] id: CHEBI:136235 name: phosphatidylinositol 36:4 is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:136236 name: phosphatidylinositol 36:2 is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:136239 name: phosphatidylinositol 38:4 is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:136243 name: phosphatidylinositol 34:2 is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:136256 name: phosphatidylserine 36:1 is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:136257 name: phosphatidylserine 36:2 is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:136282 name: 9-[(9Z)-octadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136286 name: 9-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:136302 name: 12-[(9Z)-octadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136303 name: 13-[(9Z)-octadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136304 name: 13-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:136309 name: 9-[(9Z)-hexadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136312 name: 12-[(9Z)-hexadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136315 name: 13-[(9Z)-hexadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136330 name: 12-(octadecanoyloxy)octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136335 name: 13-(octadecanoyloxy)octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136351 name: 5,6-epoxy-(8Z,11Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176588 ! oxidized icosatrienoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136352 name: (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid [Term] id: CHEBI:136353 name: (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid [Term] id: CHEBI:136354 name: (4Z,7Z,10Z,12E,16Z)-14-hydroperoxydocosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid [Term] id: CHEBI:136355 name: 5(S),6(S)-epoxy-18-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:136369 name: 5-[(9Z)-hexadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:13637 name: flavanone 7-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:72730 ! flavanone glycoside [Term] id: CHEBI:136370 name: 5-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:136373 name: 9-(octadecanoyloxy)octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136389 name: 5-[(9Z)-octadecenoyloxy]octadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136396 name: 4-O-[1-D-ribitylphosphono-(2R)-1-glycerylphosphono]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:136397 name: (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136398 name: N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactoside(1-) subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates [Term] id: CHEBI:136400 name: 8(S),15(S)-DiHPETE is_a: CHEBI:138293 ! bis(hydroperoxy)icosatetraenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136401 name: 14(R),15(S)-DiHPETE is_a: CHEBI:138293 ! bis(hydroperoxy)icosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136406 name: 13-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid [Term] id: CHEBI:136407 name: 5-hydroxy-(6E,8Z,11Z,14Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176587 ! oxidized eicosatetraenoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136408 name: 12-hydroxy-(5Z,8Z,10E,14Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176587 ! oxidized eicosatetraenoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136409 name: 15-hydroxy-(5Z,8Z,11Z,13E)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:176587 ! oxidized eicosatetraenoyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136410 name: (4Z,7Z,10Z,13Z,16Z,19R,20S)-19,20-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:136411 name: (4Z,7Z,10Z,13Z,16Z,19S,20R)-19,20-epoxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:136412 name: 5'-end 2'-deoxyribonucleotide(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136413 name: adenosine-5'-diphospho-5'-(2'-deoxyribonucleotide) residue(2-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136414 name: adenosine-5'-diphospho-5'-ribonucleotide-2'-deoxyribonucleotide residue(3-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136415 name: 5'-phosphate ribonucleotide-(2'-deoxyribonucleotide) residue(3-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136416 name: 5'-end 2'-deoxyribonucleoside residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:136418 name: guanosine-5'-diphospho-5'-(2'-deoxyribonucleotide)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136419 name: 3'-end 2'-deoxyribonucleotide-3'-diphospho-5'-guanosine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136420 name: 3'-end 5'-phosphate-ribonucleotide(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136422 name: (Z)-desulfoglucotropeolin subset: chebi_ph7_3 is_a: CHEBI:15911 ! desulfoglucotropeolin [Term] id: CHEBI:136424 name: (E)-omega-[(methylsulfanyl)alkyl]thiohydroximate subset: chebi_ph7_3 is_a: CHEBI:84291 ! organic sulfur anion [Term] id: CHEBI:136425 name: omega-(methylsulfanyl)alkyl desulfoglucosinolate subset: chebi_ph7_3 is_a: CHEBI:136442 ! desulfoglucosinolic acid [Term] id: CHEBI:136428 name: N-hydroxyimidothioate subset: chebi_ph7_3 is_a: CHEBI:83991 ! imidothioate [Term] id: CHEBI:13643 name: glycol is_a: CHEBI:23824 ! diol [Term] id: CHEBI:136432 name: (E)-2-(indol-3-yl)-1-thioacetohydroximate subset: chebi_ph7_3 is_a: CHEBI:84291 ! organic sulfur anion [Term] id: CHEBI:136433 name: 2,5-diimino-3,4-bis(indol-3-yl)hexanedioic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:33272 ! ketimine is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:136434 name: omega-[(methylsulfanyl)alkyl]glucosinolate subset: chebi_ph7_3 is_a: CHEBI:62651 ! thia-alkylglucosinolate [Term] id: CHEBI:136435 name: omega-[(methylsulfinyl)alkyl]glucosinolate subset: chebi_ph7_3 is_a: CHEBI:36445 ! alkylglucosinolate [Term] id: CHEBI:136436 name: 2-hydroxy-(indol-3-yl)acetate subset: chebi_ph7_3 is_a: CHEBI:38468 ! indol-3-yl carboxylic acid anion [Term] id: CHEBI:136437 name: 3,4-bis(7-chloroindol-3-yl)-2,5-diiminohexanedioic acid is_a: CHEBI:33272 ! ketimine is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:52508 ! chloroindole [Term] id: CHEBI:136438 name: D-thioglucoside is_a: CHEBI:9553 ! thioglucoside [Term] id: CHEBI:136439 name: (5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) [Term] id: CHEBI:136440 name: beta-D-thioglucoside is_a: CHEBI:136438 ! D-thioglucoside [Term] id: CHEBI:136441 name: (5Z,8Z,14Z,17Z)-11,12-epoxyicosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) [Term] id: CHEBI:136442 name: desulfoglucosinolic acid subset: chebi_ph7_3 is_a: CHEBI:136428 ! N-hydroxyimidothioate is_a: CHEBI:136440 ! beta-D-thioglucoside [Term] id: CHEBI:136443 name: (5Z,8Z,11Z,17Z)-14,15-epoxyicosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) [Term] id: CHEBI:136444 name: (E)-1-(glutathion-S-yl)-2-(indol-3-yl)acetohydroximate(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:136445 name: 1-aci-nitro-2-(1H-indol-3-yl)ethane subset: chebi_ph7_3 is_a: CHEBI:136622 ! aci-nitro compound is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:136447 name: (Z)-1-(glutathione-S-yl)-2-phenylacetohydroximate(1-) subset: chebi_ph7_3 is_a: CHEBI:90779 ! S-substituted glutathione(1-) [Term] id: CHEBI:136448 name: Cer(d18:0/18:1) subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:136456 name: glycolaldehyde phosphate is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25381 ! monoalkyl phosphate [Term] id: CHEBI:136471 name: phosphatidylethanolamine (16:1/16:1) is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:136485 name: 8(S),15(S)-DiHETE is_a: CHEBI:88456 ! 8,15-DiHETE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136492 name: N-(2,6-diethylphenyl)-2-chloroacetamide subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:136493 name: phosphatidylinositol (16:0/18:2) is_a: CHEBI:136243 ! phosphatidylinositol 34:2 [Term] id: CHEBI:136494 name: N-(2-ethyl-6-methylphenyl)-2-chloroacetamide subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62733 ! aromatic amide [Term] id: CHEBI:136505 name: homocysteine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:136507 name: mycobilin a(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:136508 name: mycobilin b(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:136509 name: biliverdin beta(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:136510 name: biliverdin delta(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:136511 name: manganese dioxide subset: chebi_ph7_3 is_a: CHEBI:133331 ! metal oxide is_a: CHEBI:25154 ! manganese molecular entity [Term] id: CHEBI:136512 name: bacteriochlorophyllide e(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:136513 name: 7,7-dihydroxybacteriochlorophyllide c(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:136514 name: indol-3-ylmethylamine(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:136515 name: 3-(methylaminomethyl)indole(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:136516 name: gramine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:136517 name: anaerobilin dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35285 ! iminium betaine [Term] id: CHEBI:136518 name: 8-amino-8-demethylriboflavin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:136520 name: 8-demethyl-8-(methylamino)riboflavin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:136521 name: roseoflavin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:136522 name: (9Z,12Z)-11-hydroxyoctadecadienoate subset: chebi_ph7_3 is_a: CHEBI:131861 ! HODE(1-) [Term] id: CHEBI:136523 name: 7-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:136524 name: 13-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:136531 name: 13-oxo-9,11-octadecadienoic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:72812 ! oxooctadecadienoic acid [Term] id: CHEBI:136539 name: 11-dehydro-thromboxane B2(1-) subset: chebi_ph7_3 is_a: CHEBI:62945 ! thromboxane anion [Term] id: CHEBI:136541 name: (R)-2-(phosphonomethyl)malate(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:136542 name: (+)-sesamin monocatechol subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:33566 ! catechols is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:47790 ! furofuran [Term] id: CHEBI:136543 name: (+)-sesamin dicatechol subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:33566 ! catechols is_a: CHEBI:47790 ! furofuran relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:136544 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:60105 ! alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl(1-) group [Term] id: CHEBI:136545 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136557 name: (4aS,10bR)-noroxomaritidine is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:136560 name: (4aR,10bS)-noroxomaritidine is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:136562 name: long-chain fatty acyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:83622 ! fatty acyl-AMP(1-) [Term] id: CHEBI:136563 name: (4Z,7Z,10Z,16Z,19Z)-13,14-epoxydocosapentaenoic acid is_a: CHEBI:72654 ! epoxydocosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136564 name: (R)-dyspropterin subset: chebi_ph7_3 is_a: CHEBI:17804 ! dyspropterin [Term] id: CHEBI:136565 name: (6R)-6-lactoyl-5,6,7,8-tetrahydropterin subset: chebi_ph7_3 is_a: CHEBI:17248 ! 6-lactoyl-5,6,7,8-tetrahydropterin is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:136566 name: (24S)-hydroxycholesterol 24-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167105 ! cholestane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136567 name: (24S)-hydroxycholesterol 3-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167105 ! cholestane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136568 name: (24S)-hydroxycholesterol 3,24-disulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:167105 ! cholestane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136569 name: (4Z,7Z,13Z,16Z,19Z)-10,11-epoxydocosapentaenoic acid is_a: CHEBI:72654 ! epoxydocosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136570 name: (6R)-5,6,7,8-tetrahydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:15372 ! 5,6,7,8-tetrahydrobiopterin [Term] id: CHEBI:136572 name: (6R)-5,10-methylenetetrahydrofolate poly(gamma-L-glutamate) macromolecule subset: chebi_ph7_3 is_a: CHEBI:60473 ! 5,10-methylenetetrahydrofolate polyglutamate macromolecule [Term] id: CHEBI:136573 name: (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid is_a: CHEBI:136574 ! epoxydocosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136574 name: epoxydocosatetraenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:136575 name: (7Z,10Z,13Z,19Z)-16,17-epoxydocosatetraenoic acid is_a: CHEBI:136574 ! epoxydocosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136576 name: (7Z,10Z,16Z,19Z)-13,14-epoxydocosatetraenoic acid is_a: CHEBI:136574 ! epoxydocosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136579 name: cholesterol sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167105 ! cholestane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136581 name: 2-hydroxy-(indol-3-yl)acetic acid is_a: CHEBI:24803 ! indole-3-acetic acids is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:136582 name: 17beta-estradiol 3-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136583 name: (7Z,13Z,16Z,19Z)-10,11-epoxydocosatetraenoic acid is_a: CHEBI:136574 ! epoxydocosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136584 name: (4Z,7Z,10Z,13Z,16Z)-20-hydroxydocosapentaenoic acid is_a: CHEBI:134651 ! hydroxydocosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136587 name: (4Z,7Z,11Z,13Z,15E,17S,19Z)-10,17-bis(hydroperoxy)docosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136588 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:136589 name: N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:146021 ! N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminide(1-) is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136590 name: 4-O-phosphonato-D-threonate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136591 name: D-erythronate subset: chebi_ph7_3 is_a: CHEBI:133792 ! erythronate [Term] id: CHEBI:136592 name: (S)-2-hydroxy-3-oxo-4-(phosphonatooxy)butanoate(3-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136593 name: (R)-2-hydroxy-3-oxo-4-(phosphonatooxy)butanoate(3-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136594 name: (4Z,7Z,11Z,13Z,15E,17S)-10,17-bis(hydroperoxy)docosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136595 name: (7Z,11Z,13Z,15E,19Z)-10,17-bis(hydroperoxy)docosapentaenoic acid is_a: CHEBI:189823 ! hydroperoxydocosapentaenoic acid [Term] id: CHEBI:136596 name: 4-hydroxy monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136597 name: 12-oxo-6-trans-leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:136598 name: 3-amino-D-alanine is_a: CHEBI:18383 ! 3-aminoalanine is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:136599 name: 3-amino-D-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:136602 name: (1->4)-6-phospho-alpha-D-glucan is_a: CHEBI:71298 ! glucan derivative [Term] id: CHEBI:136606 name: N-arachidonoyl-L-phenylalanine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:77673 ! N-acyl-L-phenylalanine [Term] id: CHEBI:136614 name: N-oleoyl-L-serine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:136615 name: N-oleoyl-L-glutamine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:24317 ! L-glutamine derivative [Term] id: CHEBI:136616 name: N-oleoyl-L-leucine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:25018 ! L-leucine derivative [Term] id: CHEBI:136618 name: N-[(9Z)-hexadecenoyl]glycine is_a: CHEBI:134150 ! N-acylglycine 16:1 is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:136622 name: aci-nitro compound is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:136623 name: N-octadecanoylglycine is_a: CHEBI:134151 ! N-acylglycine 18:0 is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:136624 name: 2,6-O-bis(alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:136625 name: 2-O-(alpha-D-mannopyranosyl)-6-O-(6-acyl-alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:136626 name: (8R,9E,11Z,14Z)-8-hydroperoxyicosatrienoic acid is_a: CHEBI:136627 ! hydroperoxyicosatrienoic acid [Term] id: CHEBI:136627 name: hydroperoxyicosatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:136630 name: (8Z,11Z,14Z)-10-hydroperoxyicosatrienoic acid is_a: CHEBI:136627 ! hydroperoxyicosatrienoic acid [Term] id: CHEBI:136631 name: (8Z,12E,14Z)-11-hydroperoxyicosatrienoic acid is_a: CHEBI:136627 ! hydroperoxyicosatrienoic acid [Term] id: CHEBI:136632 name: (5Z,8R,9Z,11Z,14Z)-8,9-epoxyicosatetraenoic acid is_a: CHEBI:72852 ! EpETE [Term] id: CHEBI:136633 name: (9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:136634 name: estrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136635 name: 16alpha-hydroxyestrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136636 name: 16alpha-hydroxyestrone 16-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136637 name: steroid glucosiduronic acid anion is_a: CHEBI:50160 ! steroid acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136638 name: 9-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid [Term] id: CHEBI:136639 name: testosterone 17-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167106 ! androstane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136640 name: (3R)-1,2-didehydro-3-hydroxy-16-methoxy-2,3-dihydrotabersoninium subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:136641 name: 17beta-estradiol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136642 name: 17alpha-estradiol 17-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136649 name: estriol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136650 name: estriol 16-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136653 name: 20-hydroxyprostaglandin E2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:136654 name: 13(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:136524 ! 13-HETE(1-) [Term] id: CHEBI:136655 name: 13(R)-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:133819 ! 13-HODE(1-) is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:136656 name: (5Z,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:136657 name: (4Z,7Z,11E,13Z,16Z,19Z)-10-hydroperoxydocosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:136661 name: 20-hydroxyprostaglandin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:136662 name: (5Z,8R,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoic acid is_a: CHEBI:136656 ! (5Z,9E,11Z,14Z,17Z)-8-hydroperoxyicosapentaenoic acid [Term] id: CHEBI:136663 name: 20-hydroxyprostaglandin A1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:136668 name: (R)-3,4-dihydroxy-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136669 name: (S)-3,4-dihydroxy-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136670 name: (S)-2,4-dihydroxy-3-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136672 name: N-hexadecanoyl-1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:136673 name: epitestosterone 17-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167106 ! androstane conjugate is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136674 name: (acetamidomethyl)phosphonic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:26069 ! phosphonic acids [Term] id: CHEBI:136675 name: (S)-(1-aminoethyl)phosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:136677 name: [(S)-1-acetamidoethyl]phosphonic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:26069 ! phosphonic acids [Term] id: CHEBI:136678 name: 4',7-dihydroxyflavanone subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38749 ! dihydroxyflavanone relationship: has_role CHEBI:140165 ! Brassica napus metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite [Term] id: CHEBI:136679 name: (R)-2-amino-4-oxopentanoic acid is_a: CHEBI:15914 ! 2-amino-4-oxopentanoic acid is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:136682 name: tembetarine subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:136683 name: N-arachidonoyl-L-leucine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:25018 ! L-leucine derivative [Term] id: CHEBI:136686 name: (9Z,11S,12Z,15Z)-11-hydroperoxyoctadecatrienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:136687 name: 2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:37814 ! dialkylglycerophosphoethanolamine is_a: CHEBI:76170 ! olefinic phospholipid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:136688 name: N-acetyl-alpha-D-glucosaminyl-L-tyrosine is_a: CHEBI:21990 ! O(4')-glycosyl-L-tyrosine [Term] id: CHEBI:136698 name: 3-oxochenodeoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:136699 name: S-adenosyl-S-carboxymethyl-L-homocysteine is_a: CHEBI:25697 ! organic cation is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:136700 name: 3-oxocholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:136701 name: 3-oxodeoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:136702 name: ximelagatran (hydroxylamine form) is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:140326 ! tertiary carboxamide is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:136703 name: 3-oxocholan-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:136704 name: N-propanoyl-L-methioninate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:149737 ! N-(fatty acyl)-L-methionine(1-) [Term] id: CHEBI:136707 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannosyl-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:136708 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-6-O-phosphonato-alpha-D-mannosyl-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136709 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannosyl-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:136710 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-6-O-phosphonato-alpha-D-mannosyl-L-threonine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136711 name: N-oleoyl-L-isoleucine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:136712 name: pivaloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) [Term] id: CHEBI:136713 name: N-oleoyl-L-glutamic acid is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid [Term] id: CHEBI:136714 name: C-terminal-gamma-(L-glutamyl)-L-glutamyl(3-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136716 name: N-(fatty acyl)-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:136717 name: C-terminal-gamma-(5-phospho-L-glutamyl )-L-glutamyl(4-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136730 name: (S)-all-trans-4-hydroxyretinoic acid is_a: CHEBI:63795 ! all-trans-4-hydroxyretinoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136731 name: 5-hydroxymethyldeoxycytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:65262 ! pyrimidine deoxyribonucleotide(1-) residue [Term] id: CHEBI:136734 name: (R)-laudanosine is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:46774 ! polyether is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:136735 name: (R)-tetrahydropapaverine is_a: CHEBI:195380 ! 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline [Term] id: CHEBI:136742 name: 2-O-[alpha-D-glucosyl-(1->6)-alpha-D-glucosyl]-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136743 name: 2-O-[6-O-octanoyl-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl]-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:136746 name: 5-phospho-D-xylonic acid is_a: CHEBI:22300 ! aldonic acid phosphate is_a: CHEBI:33845 ! xylonic acid derivative [Term] id: CHEBI:136749 name: 5-phospho-D-xylonate (3-) subset: chebi_ph7_3 is_a: CHEBI:136596 ! 4-hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136750 name: D-xylono-1,4-lactone-5-phosphate is_a: CHEBI:37429 ! aldonolactone phosphate is_a: CHEBI:37581 ! gamma-lactone [Term] id: CHEBI:136751 name: D-xylono-1,4-lactone-5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136752 name: L-arabino-1,4-lactone-5-phosphate is_a: CHEBI:37429 ! aldonolactone phosphate is_a: CHEBI:37581 ! gamma-lactone [Term] id: CHEBI:136753 name: L-arabino-1,4-lactone-5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136754 name: 5-phospho-L-arabinonic acid is_a: CHEBI:33447 ! phospho sugar is_a: CHEBI:33843 ! arabinonic acid derivative [Term] id: CHEBI:136756 name: 5-phospho-L-arabinonate(3-) subset: chebi_ph7_3 is_a: CHEBI:136596 ! 4-hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136757 name: long-chain (3S)-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136758 name: long-chain 3-oxo-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:136759 name: (22E)-3-oxochola-4,22-dien-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:136760 name: short-chain (3S)-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:136761 name: C-terminal-gamma-(L-glutamyl 5-semialdehyde)-L-glutamyl(2-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136763 name: C-terminal-gamma-(L-ornithyl)-L-glutamyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:136765 name: L-alpha-phenylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:136766 name: N-acetyl-L-alpha-phenylglycinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:136769 name: alpha-D-galactopyranosyl-(1->2)-alpha-D-glucopyranosyl-(1->3)-1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:63779 ! alpha-D-Gal-(1->2)-alpha-D-Glc-(1->3')-1,2-diacylglycerol [Term] id: CHEBI:136798 name: 4-thiouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136799 name: 5-methyl-2-thiouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136810 name: 12-hydroxyjasmonates subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136811 name: 12-sulfojasmonate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:136812 name: 11-hydroxyjasmonate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136813 name: 11-sulfojasmonate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:136819 name: 5-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid [Term] id: CHEBI:136820 name: RNA polyanion 2',3'-cyclic phosphate subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:136821 name: RNA polyanion nucleotide 2'-phosphate subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:136822 name: cyclobis-(1->6)-alpha-nigerosyl subset: chebi_ph7_3 is_a: CHEBI:50126 ! tetrasaccharide is_a: CHEBI:51026 ! macrocycle [Term] id: CHEBI:136823 name: alpha-D-Glcp-(1->6)-alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->6)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:147369 ! glucotetraose [Term] id: CHEBI:136824 name: mandelamide subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:136825 name: (E)-1-(glycyl-L-cystein-S-yl)-omega-(methylthio)alkylhydroximate zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:136826 name: xanthogalenol is_a: CHEBI:23086 ! chalcones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:136828 name: 4'-O-methylxanthohumol is_a: CHEBI:23086 ! chalcones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor [Term] id: CHEBI:136829 name: 1-aci-nitro-2-(phenyl)ethane subset: chebi_ph7_3 is_a: CHEBI:136622 ! aci-nitro compound is_a: CHEBI:22712 ! benzenes [Term] id: CHEBI:136830 name: S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:136831 name: S-[(E)-N-hydroxy-2-(indol-3-yl)ethanimidoyl]-L-cysteinylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:136832 name: Cys(IAN)-Gly zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:136833 name: glycolaldehyde triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136834 name: 2-sulfenohercynine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:51334 ! SO-thioperoxol is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:136840 name: pheophytin a(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:136841 name: nickel-sirohydrochlorin(8-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:136842 name: tenuazonic acid(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:136848 name: beta-bitter acid is_a: CHEBI:23824 ! diol is_a: CHEBI:33823 ! enol is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:136849 name: 3-oxo-Delta(4)-steroid group subset: chebi_ph7_3 is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:136850 name: 2-acyl-4,6-diprenylphloroglucinol is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:136851 name: colupulone is_a: CHEBI:136848 ! beta-bitter acid [Term] id: CHEBI:136852 name: adlupulone is_a: CHEBI:136848 ! beta-bitter acid [Term] id: CHEBI:136853 name: 3-(acyloxy)acyl group subset: chebi_ph7_3 is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:136856 name: O-succinyl-L-serinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:136857 name: N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:136858 name: beta-D-Delta(4)-GlcpA-(1->4)-beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-D-Glcp is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:136859 name: pro-agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:136860 name: antidote to sarin poisoning is_a: CHEBI:50247 ! antidote [Term] id: CHEBI:136873 name: oligoglycosyl-(1->4)-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:156536 ! oligoglycosyl-(1->4)-D-glucose is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:136875 name: oligoglycosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide subset: chebi_ph7_3 is_a: CHEBI:62941 ! glycosylceramide [Term] id: CHEBI:136876 name: 1-(3,4-dihydroxybenzoyl)-beta-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:52782 ! O-acyl carbohydrate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:136877 name: 5-hydroxyuridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:136878 name: C2-C8-saturated long-chain fatty acyl pantetheine-4-phosphorylserine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:133243 ! O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue [Term] id: CHEBI:136879 name: 5-(carboxymethoxy)uridine 5'-phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136881 name: 3-carboxy-3-hydroxypropanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:136882 name: 17-epiestriol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136883 name: 17-epiestriol 17-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136884 name: 17-epiestriol 16-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136885 name: 16-epiestriol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136886 name: 16-epiestriol 16-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136887 name: nickel-sirohydrochlorin a,c-diamide(6-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion is_a: CHEBI:59360 ! hexacarboxylic acid anion [Term] id: CHEBI:136888 name: 15,17(3)-seco-F430-17(3)-acid(6-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion is_a: CHEBI:59360 ! hexacarboxylic acid anion [Term] id: CHEBI:136889 name: 5beta steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:136890 name: 3-dimethylallyl-4-hydroxymandelate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:136891 name: 2'-unsubstituted isoflavones subset: chebi_ph7_3 is_a: CHEBI:38757 ! isoflavones [Term] id: CHEBI:136895 name: dTDP-L-rhamnose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:136896 name: 5'-(5'-triphosphoguanosine)-(purine-ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:167617 ! 5'-(5'-triphosphoguanosine)-(ribonucleotide)(3-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136897 name: O-[S-(3S)-hydroxy-3-methylglutarylpantetheine-4'-phosphoryl]-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:136899 name: chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136900 name: cholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136901 name: deoxycholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136902 name: lithocholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136903 name: hyodeoxycholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136904 name: hyocholic acid 24-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136905 name: hyodeoxycholate 6-O-(beta-D-glucuronide)(2-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136906 name: hyocholate 6-O-(beta-D-glucuronide)(2-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136907 name: (7S)-7-hydroxy-C2-C8-saturated long-chain fatty acyl pantetheine-4-phosphorylserine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:133243 ! O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue is_a: CHEBI:133479 ! S-(long-chain fatty acyl)-L-cysteine residue [Term] id: CHEBI:136908 name: (7R,8R)-7,8-dihydroxy-C2-C8-saturated long-chain fatty acyl pantetheine-4-phosphorylserine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:133243 ! O-[S-(long-chain fatty acyl)pantetheine-4'-phosphoryl]serine(1-) residue [Term] id: CHEBI:136910 name: O-[S-(7-oxoheptanoyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:136911 name: N-(4-ammoniobutylidene)-L-lysinium(2+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:136912 name: 1,2-diacyl-sn-glycero-3-phospholipid subset: chebi_ph7_3 is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:136913 name: monoacyl-sn-glycero-3-phospholipid subset: chebi_ph7_3 is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:136914 name: 5alpha-dihydrotestosterone 17-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167106 ! androstane conjugate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136916 name: 5alpha-dihydrotestosterone 17-O-[beta-D-glucuronosyl-(1->2)-glucuronide](2-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167106 ! androstane conjugate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:136931 name: 2-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136933 name: 2-hydroxy-17beta-estradiol 2-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136936 name: 4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136937 name: 4-hydroxy-17beta-estradiol 4-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136949 name: coniferaldehyde beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:51688 ! enal is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite [Term] id: CHEBI:136960 name: ditrans,polycis-polyprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:167056 ! polyprenol diphosphate(3-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:136965 name: lithocholate 3-O-(beta-D-glucuronide)(2-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136966 name: 3beta-hydroxysteroid-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:136967 name: 2-hydroxyestrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136969 name: 4-hydroxyestrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136970 name: 4-hydroxyestrone 4-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136971 name: 2-methoxyestrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136972 name: 4-methoxyestrone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:136973 name: 4-methoxyestrone 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136974 name: 2-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136975 name: 4-methoxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:136976 name: 4-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:136977 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)-(ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:167612 ! 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)-(ribonucleotide)(3-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136978 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)-(2'-O-methyl-ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:167614 ! 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)-(2'-O-methyl-ribonucleotide)(3-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136979 name: isowyosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:136980 name: 2-hydroxy-3-O-methyl estrone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36857 ! 2-hydroxy steroid [Term] id: CHEBI:136982 name: 5alpha-dihydrotestosterone sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136983 name: (3beta,5alpha,17beta)-3-hydroxyandrostan-17-yl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:136984 name: EC 4.4.1.14 (1-aminocyclopropane-1-carboxylate synthase) inhibitor is_a: CHEBI:76831 ! EC 4.4.1.* (C-S lyase) inhibitor [Term] id: CHEBI:136985 name: S-prenyl-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:137935 ! S-polyprenyl-L-cysteine zwitterion is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:136986 name: 2-hydroxyhexacosanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:136987 name: N-[(2S)-2-amino-2-carboxyethyl]-L-glutamic acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:83982 ! L-glutamic acid derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:136988 name: N-[(8Z,11Z,14Z)-5,6-epoxyicosatrienoyl]ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:167118 ! oxidized N-(fatty acyl)-ethanolamine is_a: CHEBI:32955 ! epoxide is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136989 name: N-[(5Z,11Z,14Z)-8,9-epoxyicosatrienoyl]ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:167118 ! oxidized N-(fatty acyl)-ethanolamine is_a: CHEBI:32955 ! epoxide is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136990 name: N-[(5Z,8Z,14Z)-11,12-epoxyicosatrienoyl]ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:167118 ! oxidized N-(fatty acyl)-ethanolamine is_a: CHEBI:32955 ! epoxide is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136991 name: N-[(5Z,8Z,11Z)-14,15-epoxyicosatrienoyl]ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:167118 ! oxidized N-(fatty acyl)-ethanolamine is_a: CHEBI:32955 ! epoxide is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136992 name: N-(20-hydroxyarachidonoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:167118 ! oxidized N-(fatty acyl)-ethanolamine is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85281 ! N-(polyunsaturated fatty acyl)ethanolamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136994 name: 2-(glutathion-S-yl)-1,4-hydroquinone is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:35683 ! aryl sulfide relationship: has_role CHEBI:50909 ! nephrotoxic agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:136996 name: 9-[(9Z)-octadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:136997 name: L-polyhomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:136998 name: L-dihomomethionine is_a: CHEBI:136997 ! L-polyhomomethionine is_a: CHEBI:50710 ! dihomomethionine [Term] id: CHEBI:136999 name: L-trihomomethionine is_a: CHEBI:136997 ! L-polyhomomethionine is_a: CHEBI:50711 ! trihomomethionine [Term] id: CHEBI:137000 name: C-terminal Xaa-Gly(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137001 name: C-terminal alpha-amino-acid amide residue subset: chebi_ph7_3 is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:137002 name: L-tetrahomomethionine is_a: CHEBI:136997 ! L-polyhomomethionine is_a: CHEBI:50712 ! tetrahomomethionine [Term] id: CHEBI:137003 name: C-terminal Xaa-hydroxyglycino(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137004 name: L-pentahomomethionine is_a: CHEBI:136997 ! L-polyhomomethionine is_a: CHEBI:50713 ! pentahomomethionine [Term] id: CHEBI:137005 name: L-hexahomomethionine is_a: CHEBI:136997 ! L-polyhomomethionine is_a: CHEBI:50714 ! hexahomomethionine [Term] id: CHEBI:137006 name: N-hydroxy-L-polyhomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:137007 name: N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:137009 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-hexadecanoyl)ethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:140403 ! N-acyl-1-[(1Z)-alkenyl]-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:137010 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-oleoyl)ethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:137015 name: 3-dehydro-scyllo-inosose subset: chebi_ph7_3 is_a: CHEBI:64809 ! tetrahydroxycyclohexanone is_a: CHEBI:67265 ! beta-diketone relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:137016 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-arachidonoyl)ethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:137017 name: 1-(1Z-octadecenyl)-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77283 ! 1-(Z)-alk-1-enyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:137021 name: 5(S),6(S)-epoxy-18(S)-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoic acid is_a: CHEBI:136355 ! 5(S),6(S)-epoxy-18-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137022 name: N-hydroxy-L-dihomomethionine is_a: CHEBI:137006 ! N-hydroxy-L-polyhomomethionine is_a: CHEBI:50758 ! N-hydroxydihomomethionine [Term] id: CHEBI:137023 name: N-hydroxy-L-trihomomethionine is_a: CHEBI:137006 ! N-hydroxy-L-polyhomomethionine is_a: CHEBI:50761 ! N-hydroxytrihomomethionine [Term] id: CHEBI:137024 name: N-hydroxy-L-tetrahomomethionine is_a: CHEBI:137006 ! N-hydroxy-L-polyhomomethionine is_a: CHEBI:50762 ! N-hydroxytetrahomomethionine [Term] id: CHEBI:137025 name: N-hydroxy-L-pentahomomethionine is_a: CHEBI:137006 ! N-hydroxy-L-polyhomomethionine is_a: CHEBI:50763 ! N-hydroxypentahomomethionine [Term] id: CHEBI:137026 name: N-hydroxy-L-hexahomomethionine is_a: CHEBI:137006 ! N-hydroxy-L-polyhomomethionine is_a: CHEBI:50764 ! N-hydroxyhexahomomethionine [Term] id: CHEBI:137027 name: N,N-dihydroxy-L-dihomomethionine is_a: CHEBI:137007 ! N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:50767 ! N,N-dihydroxydihomomethionine [Term] id: CHEBI:137028 name: N,N-dihydroxy-L-trihomomethionine is_a: CHEBI:137007 ! N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:50768 ! N,N-dihydroxytrihomomethionine [Term] id: CHEBI:137029 name: N,N-dihydroxy-L-tetrahomomethionine is_a: CHEBI:137007 ! N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:58848 ! N,N-dihydroxytetrahomomethioninate [Term] id: CHEBI:137030 name: N,N-dihydroxy-L-pentahomomethionine is_a: CHEBI:137007 ! N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:50770 ! N,N-dihydroxypentahomomethionine [Term] id: CHEBI:137031 name: 19-hydroxy-5alpha-dihydrotestosterone subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36842 ! 19-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137032 name: 19-oxo-5alpha-dihydrotestosterone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:38149 ! 19-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137033 name: N,N-dihydroxy-L-hexahomomethionine is_a: CHEBI:137007 ! N,N-dihydroxy-L-polyhomomethionine is_a: CHEBI:50765 ! N,N-dihydroxyhexahomomethionine [Term] id: CHEBI:137037 name: 18-hydroxy-5alpha-dihydrotestosterone subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36855 ! 18-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137039 name: 8,9-epoxy-(5Z,11Z,14Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:137040 name: short chain fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:137041 name: quinine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:51323 ! cinchona alkaloid relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:51371 ! muscle relaxant [Term] id: CHEBI:137043 name: N-[(+)-7-isojasmonyl]-L-isoleucine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative relationship: has_role CHEBI:24937 ! jasmonates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137044 name: N-[(+)-12-hydroxy-7-isojasmonyl]isoleucine is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative relationship: has_role CHEBI:140165 ! Brassica napus metabolite [Term] id: CHEBI:137046 name: 6beta,16alpha,17alpha-trihydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:137047 name: 11,12-epoxy-(5Z,8Z,14Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:137049 name: 16alpha,17alpha-dihydroxypregnenolone subset: chebi_ph7_3 is_a: CHEBI:131698 ! pregnane sterol is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36730 ! hydroxypregnenolone [Term] id: CHEBI:13705 name: acetoacetate subset: chebi_ph7_3 is_a: CHEBI:133292 ! 3-oxo fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137050 name: 14,15-epoxy-(5Z,8Z,11Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:137053 name: (24Z),26-hydroxydesmosterol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137057 name: cholesta-5,7-dien-3beta,25-diol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36864 ! 25-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137061 name: cholesta-5,7-dien-3beta,24S-diol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137062 name: 7-oxo-5alpha-cholestan-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137063 name: cholestanol 7alpha,8alpha-epoxide subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137076 name: 1beta-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid is_a: CHEBI:71017 ! 1-hydroxy steroid [Term] id: CHEBI:137077 name: 2beta-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:86013 ! 2-hydroxytestosterone relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137082 name: 12-[(9Z)-octadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137083 name: 13-[(9Z)-octadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137084 name: 9-[(9Z)-hexadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137085 name: 12-[(9Z)-hexadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137086 name: 13-[(9Z)-hexadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137089 name: 12-(octadecanoyloxy)octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:85208 ! 12-hydroxyoctadecanoic acid [Term] id: CHEBI:137091 name: 13-(octadecanoyloxy)octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137097 name: 9-(octadecanoyloxy)octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137102 name: 5-[(9Z)-hexadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137106 name: 5-[(9Z)-octadecenoyloxy]octadecanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:137107 name: 5,6-epoxy-(8Z,11Z,14Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:137108 name: 5-dehydro-L-gluconate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:60978 ! ketogluconate [Term] id: CHEBI:137109 name: (2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:13711 name: acetyl phosphate(1-) is_a: CHEBI:60199 ! acyl monophosphate(1-) relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:137110 name: 17beta-hydroxy-5alpha-estr-1(10)-en-3-one subset: chebi_ph7_3 is_a: CHEBI:131591 ! C18-steroid is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid [Term] id: CHEBI:137111 name: 5-hydroxy-(6E,8Z,11Z,14Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:137112 name: 12-hydroxy-(5Z,8Z,10E,14Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:137116 name: N-carbamoyl-L-methioninate subset: chebi_ph7_3 is_a: CHEBI:58865 ! N-carbamoyl-L-alpha-amino acid anion [Term] id: CHEBI:137117 name: (S)-5-[2-(methylthio)ethyl]hydantoin subset: chebi_ph7_3 is_a: CHEBI:86340 ! L-5-monosubstituted hydantoin [Term] id: CHEBI:137132 name: 8-[(1S,2S)-3-oxo-2-\{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid is_a: CHEBI:191853 ! 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:13714 name: 1-O-acetylmaltose subset: chebi_ph7_3 is_a: CHEBI:52782 ! O-acyl carbohydrate is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:137145 name: 15-hydroxy-(5Z,8Z,11Z,13E)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:137150 name: (R)-5-[2-(methylthio)ethyl]hydantoin subset: chebi_ph7_3 is_a: CHEBI:86339 ! D-5-monosubstituted hydantoin [Term] id: CHEBI:137152 name: N-carbamoyl-D-methioninate subset: chebi_ph7_3 is_a: CHEBI:85602 ! N-carbamoyl-D-alpha-amino acid anion [Term] id: CHEBI:137154 name: (4Z,7Z,10Z,13Z,16Z,19R,20S)-19,20-epoxydocosapentaenoic acid is_a: CHEBI:72653 ! (4Z,7Z,10Z,13Z,16Z)-19,20-epoxydocosapentaenoic acid [Term] id: CHEBI:137155 name: phosphatidylserine 36:3 is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:137156 name: phosphatidylserine(18:1/18:2) is_a: CHEBI:137155 ! phosphatidylserine 36:3 [Term] id: CHEBI:137165 name: (S)-6-acetamido-3-aminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:58498 ! 6-acetamido-3-aminohexanoic acid zwitterion [Term] id: CHEBI:137166 name: 16(R)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:132019 ! 16-HETE(1-) [Term] id: CHEBI:137167 name: 16(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:132019 ! 16-HETE(1-) [Term] id: CHEBI:137168 name: alpha-D-mannosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137169 name: alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137172 name: prostaglandin E2 2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:26338 ! prostaglandins E is_a: CHEBI:33573 ! tetrol is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:137179 name: UDP-2,3-diacyl-alpha-D-glucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137180 name: 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137182 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:137183 name: (4Z,7Z,10Z,13Z,16Z,19S,20R)-19,20-epoxydocosapentaenoic acid is_a: CHEBI:72653 ! (4Z,7Z,10Z,13Z,16Z)-19,20-epoxydocosapentaenoic acid [Term] id: CHEBI:137186 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-[beta-D-Xyl-(1->2)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:137187 name: 15(S)-HPETE 2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:17389 ! 2-monoglyceride [Term] id: CHEBI:13719 name: acetylsalicylate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:137193 name: (5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid is_a: CHEBI:72852 ! EpETE [Term] id: CHEBI:1372 name: 1-pyrroline-5-carboxylic acid is_a: CHEBI:19098 ! 1-pyrrolinecarboxylic acid [Term] id: CHEBI:137207 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-[alpha-L-Fuc-(1->6)]-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:137211 name: (E)-2-(indol-3-yl)-1-thioacetohydroximic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:80992 ! thiohydroximic acid [Term] id: CHEBI:137257 name: omega-[(methylsulfanyl)alkyl]glucosinolic acid is_a: CHEBI:79322 ! thia-alkylglucosinolic acid [Term] id: CHEBI:137260 name: omega-[(methylsulfinyl)alkyl]glucosinolic acid is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:79327 ! alkylglucosinolic acid [Term] id: CHEBI:137265 name: (E)-1-(glutathion-S-yl)-2-(indol-3-yl)acetohydroximate is_a: CHEBI:136428 ! N-hydroxyimidothioate is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:137267 name: (5Z,8Z,14Z,17Z)-11,12-epoxyicosatetraenoic acid is_a: CHEBI:72852 ! EpETE [Term] id: CHEBI:137269 name: (5Z,8Z,11Z,17Z)-14,15-epoxyicosatetraenoic acid is_a: CHEBI:72852 ! EpETE [Term] id: CHEBI:137281 name: (Z)-1-(glutathione-S-yl)-2-phenylacetohydroximate is_a: CHEBI:136428 ! N-hydroxyimidothioate is_a: CHEBI:24335 ! glutathione conjugate [Term] id: CHEBI:137287 name: mycobilin a is_a: CHEBI:25046 ! linear tetrapyrrole is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:137297 name: mycobilin b is_a: CHEBI:25046 ! linear tetrapyrrole is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:137298 name: biliverdin beta is_a: CHEBI:25046 ! linear tetrapyrrole is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:137299 name: biliverdin delta is_a: CHEBI:25046 ! linear tetrapyrrole is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:137300 name: bacteriochlorophyllide e is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:137302 name: 7,7-dihydroxybacteriochlorophyllide c is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:137305 name: (9Z,12Z)-11-hydroxyoctadecadienoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:36328 ! HODE [Term] id: CHEBI:137310 name: 3-(methylaminomethyl)indole is_a: CHEBI:38631 ! aminoalkylindole is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137320 name: (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:137342 ! 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoate [Term] id: CHEBI:137321 name: O-(alpha-D-mannosyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137323 name: O-(alpha-D-mannosyl)-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137328 name: epoxy(hydroxy)icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:137333 name: anaerobilin is_a: CHEBI:25046 ! linear tetrapyrrole is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:137336 name: 8-amino-8-demethylriboflavin is_a: CHEBI:33573 ! tetrol is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:38925 ! benzopteridine is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:137340 name: 8-demethyl-8-(methylamino)riboflavin is_a: CHEBI:33573 ! tetrol is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:38925 ! benzopteridine is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:137342 name: 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:137343 name: (R)-2-(phosphonomethyl)malic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:137344 name: 7-HETE is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137345 name: 13-HETE is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137351 name: 5-hydroxymethyldeoxycytidine 5'-monophosphate residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:137353 name: pyridinium-3,5-biscarboxylate mononucleotide(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137355 name: 5-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137356 name: S-[5-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium-3-carbonyl]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137357 name: S-[1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridinium-3-carbonyl]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137358 name: 1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridinium-3-carbonyl adenylate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137370 name: 20-hydroxyprostaglandin E2 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26338 ! prostaglandins E is_a: CHEBI:27136 ! triol [Term] id: CHEBI:137372 name: pyridinium-3,5-bisthiocarboxylate mononucleotide(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:84291 ! organic sulfur anion [Term] id: CHEBI:137373 name: Ni(II)-pyridinium-3,5-bisthiocarboxylate mononucleotide(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:137376 name: long-chain fatty acyl-AMP is_a: CHEBI:83621 ! fatty acyl-AMP [Term] id: CHEBI:137385 name: (24S)-hydroxycholesterol 24-sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid [Term] id: CHEBI:137386 name: thymidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:140284 ! deoxyribonucleotide(1-) residue [Term] id: CHEBI:137387 name: 4-O-methyl-dTMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137388 name: (24S)-hydroxycholesterol 3-sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:36865 ! 24-hydroxy steroid [Term] id: CHEBI:137389 name: (24S)-hydroxycholesterol 3,24-disulfate is_a: CHEBI:16158 ! steroid sulfate [Term] id: CHEBI:137390 name: 19-hydroxyleukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:137391 name: 18-hydroxyleukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:137395 name: pyridinium-3,5-biscarboxylic acid mononucleotide is_a: CHEBI:17188 ! nucleoside 5'-monophosphate is_a: CHEBI:36980 ! pyridine nucleotide [Term] id: CHEBI:137396 name: 5-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium-3-carbonyl adenylate is_a: CHEBI:36980 ! pyridine nucleotide is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:137397 name: 1-(5-O-phosphono-beta-D-ribofuranosyl)-5-(sulfanylcarbonyl)pyridinium-3-carbonyl adenylate is_a: CHEBI:36980 ! pyridine nucleotide is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:137398 name: pyridinium-3,5-bisthiocarboxylic acid mononucleotide is_a: CHEBI:17188 ! nucleoside 5'-monophosphate is_a: CHEBI:35737 ! monothiocarboxylic acid is_a: CHEBI:36980 ! pyridine nucleotide [Term] id: CHEBI:137399 name: Ni(II)-pyridinium-3,5-bisthiocarboxylic acid mononucleotide is_a: CHEBI:17188 ! nucleoside 5'-monophosphate is_a: CHEBI:35438 ! nickel coordination entity is_a: CHEBI:36980 ! pyridine nucleotide relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:137403 name: 1-hexanoyl-2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:137404 name: 5-hydroxybenzimidazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137405 name: (S)-2-halocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:137406 name: (R)-2-halocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:137407 name: (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(2-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:137408 name: (13R)-glycinylcystein-S-yl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:137409 name: L-sorbose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137410 name: (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion [Term] id: CHEBI:137411 name: 1-hexadecanoyl-2-[(11Z,14Z,17Z)-icosatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:77369 ! 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:137412 name: cholesteryl (11Z,14Z,17Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:138331 ! cholesteryl icosatrienoate [Term] id: CHEBI:137419 name: secondary ammonium ion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:137429 name: N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:137455 name: (R)-2-hydroxy-3-oxo-4-(phosphonooxy)butanoic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:137456 name: (S)-3,4-dihydroxy-2-oxobutanoic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:137457 name: 9,10-epoxy-18-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:190711 ! epoxy fatty acid anion [Term] id: CHEBI:137458 name: (9S,10R)-9,10-epoxy-18-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:137457 ! 9,10-epoxy-18-hydroxyoctadecanoate [Term] id: CHEBI:137459 name: (9R,10S)-9,10-epoxy-18-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:137457 ! 9,10-epoxy-18-hydroxyoctadecanoate [Term] id: CHEBI:137460 name: (9R,10S)-9,10-epoxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:85195 ! 9,10-epoxyoctadecanoate [Term] id: CHEBI:137461 name: (9S,10R)-epoxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:85195 ! 9,10-epoxyoctadecanoate [Term] id: CHEBI:137463 name: 2,6-O-bis(alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol is_a: CHEBI:59466 ! phosphatidylinositol mannoside [Term] id: CHEBI:137467 name: 9,10-epoxy-18-hydroxy-(12Z)-octadecenoate subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:190711 ! epoxy fatty acid anion [Term] id: CHEBI:137469 name: 12,13-epoxy-18-hydroxy-(9Z)-octadecenoate subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:190711 ! epoxy fatty acid anion [Term] id: CHEBI:137474 name: 8,9-epoxy-20-hydroxy-(5Z,11Z,14Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:190711 ! epoxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:137475 name: 11,12-epoxy-20-hydroxy-(5Z,8Z,14Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:137476 name: 14,15-epoxy-20-hydroxy-(5Z,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:137480 name: 4-saturated-(3S)-hydroxyacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:137483 name: 2-O-(alpha-D-mannopyranosyl)-6-O-(6-acyl-alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:59466 ! phosphatidylinositol mannoside [Term] id: CHEBI:137485 name: (3R)-1,2-didehydro-3-hydroxy-16-methoxy-2,3-dihydrotabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137486 name: (R)-3,4-dihydroxy-2-oxobutanoic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:137487 name: (2R,5S)-2,5-diammoniohexanoate subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:137488 name: 16alpha-hydroxyestrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137489 name: 16alpha-hydroxyestrone 16-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:137490 name: 17alpha-estradiol 17-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:137491 name: epitestosterone 17-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:137494 name: 13(S)-HETE is_a: CHEBI:137345 ! 13-HETE [Term] id: CHEBI:137495 name: 13(R)-HODE is_a: CHEBI:72639 ! 13-HODE [Term] id: CHEBI:137497 name: 7-oxoresolvin D2(1-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:137498 name: 16-oxoresolvin D2(1-) subset: chebi_ph7_3 is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:137502 name: (S)-2,4-dihydroxy-3-oxobutanoic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:137514 name: TRPA1 channel agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:137522 name: (+)-isoafricanol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:137523 name: (-)-spiroviolene subset: chebi_ph7_3 is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35714 ! polycyclic olefin [Term] id: CHEBI:137524 name: CDP-D-ribulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137525 name: CDP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137526 name: 20-hydroxyprostaglandin E1 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26338 ! prostaglandins E is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:137528 name: tsukubadiene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:137529 name: 20-hydroxyprostaglandin A1 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23824 ! diol is_a: CHEBI:26334 ! prostaglandins A [Term] id: CHEBI:137530 name: (2S,3R,6S,9S)-(-)-protoillud-7-ene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:137531 name: (3S)-(+)-asterisca-2(9),6-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:137532 name: 3-oxochenodeoxycholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:137533 name: (-)-alpha-amorphene subset: chebi_ph7_3 is_a: CHEBI:22976 ! cadinene is_a: CHEBI:35714 ! polycyclic olefin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137534 name: 3-oxocholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:137535 name: (+)-corvol ether A subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37407 ! cyclic ether [Term] id: CHEBI:137536 name: (+)-corvol ether B subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37407 ! cyclic ether [Term] id: CHEBI:137537 name: 3-oxodeoxycholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:137539 name: 3-oxocholan-24-oyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:137540 name: N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannosyl-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137541 name: N-propanoyl-L-methionine is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:137542 name: (5S,6R)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate [Term] id: CHEBI:137543 name: (5S,15S)-dihydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:137544 ! bis(hydroperoxy)icosatetraenoate [Term] id: CHEBI:137544 name: bis(hydroperoxy)icosatetraenoate is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:137545 name: pivaloyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137546 name: (5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:137548 ! hydroperoxy(hydroxy)icosatetraenoate [Term] id: CHEBI:137547 name: (5S,6R)-dihydroxy-(15S)-hydroperoxy-(7E,9E,11Z,13E)-icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:137548 ! hydroperoxy(hydroxy)icosatetraenoate [Term] id: CHEBI:137548 name: hydroperoxy(hydroxy)icosatetraenoate is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:137550 name: N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid [Term] id: CHEBI:137553 name: 2-O-[6-O-octanoyl-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl]-D-glyceric acid is_a: CHEBI:24400 ! glycoside is_a: CHEBI:52782 ! O-acyl carbohydrate is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:137558 name: 2-O-[alpha-D-glucosyl-(1->6)-alpha-D-glucosyl]-D-glyceric acid is_a: CHEBI:24400 ! glycoside is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:137562 name: (+)-eremophilene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin [Term] id: CHEBI:137563 name: (1R,4R,5S)-(-)-guaia-6,10(14)-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:137564 name: (+)-(1(10)E,4E,6S,7R)-germacradien-6-ol subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:137565 name: (3E,7E)-dolabella-3,7-dien-18-ol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137566 name: EC 2.5.1.48 (cystathionine gamma-synthase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:137567 name: 11(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:78833 ! 11-HETE(1-) [Term] id: CHEBI:137568 name: Cer(d34:0) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:137569 name: Cer(d34:1) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:13757 name: n-alk-2-enal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal [Term] id: CHEBI:137570 name: Cer(d38:1) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:137572 name: Cer(d41:1) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:137574 name: Cer(d44:0) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:137580 name: 2-[(11R)-hydroxy-(5Z,8Z,12E,14Z)-icosatetraenoyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:167121 ! oxidized 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:137581 name: 2-[(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:167121 ! oxidized 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:137582 name: 2-[(11R)-hydroxy-(5Z,8Z,12E,14Z)-icosatetraenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:137583 name: 2-[(15R)-hydroxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:137584 name: 2-[(15S)-hydroxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:137585 name: 2-[(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:137586 name: alkyl,acylglyceride subset: chebi_ph7_3 is_a: CHEBI:47778 ! glyceride is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76578 ! diradylglycerol [Term] id: CHEBI:13759 name: alkylamine is_a: CHEBI:32877 ! primary amine [Term] id: CHEBI:137593 name: (2E,4Z)-deca-2,4-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:85099 ! (2E,4Z)-dienoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:137594 name: N-acetyl-alpha-D-muramate 1-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:137598 name: 4-aminosalicylate(1-) subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:137599 name: long-chain 3-oxo-fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:137600 name: 2-hydroxy-7,8-dihydropteroate subset: chebi_ph7_3 is_a: CHEBI:24675 ! hydroxybenzoate is_a: CHEBI:38796 ! pteroates [Term] id: CHEBI:137626 name: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:137639 name: long-chain (3S)-hydroxy fatty acyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:137643 name: (22E)-3-oxochola-4,22-dien-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:137650 name: short-chain (3S)-hydroxy fatty acyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:137652 name: N-acetyl-L-alpha-phenylglycine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:137661 name: allocholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:137662 name: allodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:137663 name: allocholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:137664 name: allodeoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:137667 name: 3-[beta-D-glucopyranosyl-(1->6)-beta-D-galactopyranosyl]-1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid [Term] id: CHEBI:137668 name: beta-muricholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:137669 name: S-[(Z)-N-hydroxy-2-phenylethanimidoyl]-L-cysteinylglycine is_a: CHEBI:136428 ! N-hydroxyimidothioate is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:64987 ! S-conjugate [Term] id: CHEBI:137672 name: S-[(E)-N-hydroxy-2-(indol-3-yl)ethanimidoyl]-L-cysteinylglycine is_a: CHEBI:136428 ! N-hydroxyimidothioate is_a: CHEBI:24828 ! indoles is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:64987 ! S-conjugate [Term] id: CHEBI:137673 name: 3-sulfinatopropionate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:37785 ! organosulfinate oxoanion [Term] id: CHEBI:137674 name: benzyl thiol subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:29256 ! thiol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:137675 name: thiobenzaldehyde subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:59786 ! thioaldehyde [Term] id: CHEBI:137676 name: Cys(IAN)-Gly is_a: CHEBI:18379 ! nitrile is_a: CHEBI:24828 ! indoles is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:64987 ! S-conjugate [Term] id: CHEBI:137677 name: glycolaldehyde triphosphate is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:62894 ! organic triphosphate [Term] id: CHEBI:137678 name: nickel-sirohydrochlorin is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:35438 ! nickel coordination entity [Term] id: CHEBI:137679 name: ursodeoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:137684 name: Papio hamadryas metabolite is_a: CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:137687 name: (24S)-hydroxycholestanol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:137688 name: (25R)-26-hydroxycholestanol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:13769 name: aminohydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones [Term] id: CHEBI:137696 name: nickel-sirohydrochlorin a,c-diamide is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:35438 ! nickel coordination entity [Term] id: CHEBI:137699 name: 15,17(3)-seco-F430-17(3)-acid is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:35438 ! nickel coordination entity relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:137700 name: 3-carboxy-3-hydroxypropanoyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA [Term] id: CHEBI:137701 name: 17-epiestriol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137702 name: 17-epiestriol 17-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137706 name: 17-epiestriol 16-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137720 name: 16-epiestriol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137723 name: 16-epiestriol 16-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:137724 name: 7-oxotaurolithocholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:137731 name: 5-formyl-dCMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137732 name: 5-carboxy-dCMP(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137740 name: UDP-3-O-[(3R)-hydroxyacyl]-alpha-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137748 name: UDP-2-N,3-O-bis[(3R)-3-hydroxyacyl]-alpha-D-glucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137789 name: 7,12-dioxolithocholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion [Term] id: CHEBI:137790 name: chenodeoxycholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137791 name: cholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137796 name: 2,5,6-triamino-4-hydroxypyrimidine subset: chebi_ph7_3 is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:38340 ! hydroxypyrimidine relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23240 ! chromophore [Term] id: CHEBI:137799 name: deoxycholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137807 name: lithocholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137811 name: phenoxy radical subset: chebi_ph7_3 is_a: CHEBI:36872 ! organic radical [Term] id: CHEBI:137812 name: hyodeoxycholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137817 name: hyocholic acid 24-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:52782 ! O-acyl carbohydrate relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137818 name: 7-oxoglycolithocholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:137820 name: 7-oxotaurodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:137822 name: hyodeoxycholic acid 6-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137824 name: 7-oxoglycodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:137829 name: hyocholic acid 6-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:137837 name: 2-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36857 ! 2-hydroxy steroid [Term] id: CHEBI:137852 name: phosphatidylcholine 14:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:137856 name: 5alpha-dihydrotestosterone 17-O-[beta-D-glucuronosyl-(1->2)-glucuronide] is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:137880 name: ursocholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion [Term] id: CHEBI:137881 name: 3,7,12-trioxo-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion [Term] id: CHEBI:137882 name: 7beta-hydroxy-3,12-dioxo-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion [Term] id: CHEBI:137886 name: 3alpha,7beta-dihydroxy-12-oxo-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion [Term] id: CHEBI:13790 name: N-acetylarylamine subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:137907 name: 2-hydroxy-17beta-estradiol 2-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:137911 name: 4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:62846 ! 4-hydroxy steroid [Term] id: CHEBI:137917 name: 4-hydroxy-17beta-estradiol 4-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:13792 name: N-hydroxyarylamine subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines [Term] id: CHEBI:137921 name: lithocholic acid 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:137923 name: 5'-end ribonucleotide(1-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137924 name: 2-hydroxyestrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:36857 ! 2-hydroxy steroid [Term] id: CHEBI:137927 name: CDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:138068 ! ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) is_a: CHEBI:58660 ! CDP-D-glucose(2-) [Term] id: CHEBI:137931 name: TDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:138068 ! ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:137932 name: 5-dehydro-L-gluconic acid is_a: CHEBI:24967 ! ketogluconic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:137933 name: N(4)-methyl-dCMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137934 name: polyprenal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal [Term] id: CHEBI:137935 name: S-polyprenyl-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:137941 name: beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:137942 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminide(2-) subset: chebi_ph7_3 is_a: CHEBI:149714 ! N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-D-glucosaminide(1-) is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:137945 name: N-carbamoyl-L-methionine is_a: CHEBI:51353 ! N-carbamoyl-L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:137948 name: N-carbamoyl-D-methionine is_a: CHEBI:17255 ! N-carbamoyl-D-alpha-amino acid is_a: CHEBI:84122 ! D-methionine derivative [Term] id: CHEBI:137949 name: O(3)-(beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137950 name: O(3)-(beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl)-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137952 name: UDP-2,3-diacyl-alpha-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:137954 name: N(6)-[(E)-but-2-enoyl]-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:137955 name: N(6)-butyryl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:13796 name: S-polyprenyl-L-cysteine is_a: CHEBI:47913 ! S-hydrocarbyl-L-cysteine [Term] id: CHEBI:137960 name: 4-hydroxyestrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:62846 ! 4-hydroxy steroid [Term] id: CHEBI:137961 name: 4-hydroxyestrone 4-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:137965 name: 4-methoxyestrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:137966 name: 4-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:137967 name: N(6)-acyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:137976 name: S-acetyl-O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:137979 name: D-galactosylglycerol is_a: CHEBI:24168 ! galactosylglycerol [Term] id: CHEBI:137980 name: metalloid atom is_a: CHEBI:33250 ! atom [Term] id: CHEBI:137981 name: 5-amino-1-(5-phosphonato-beta-D-ribosyl)imidazol-3-ium subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:137982 name: tertiary ammonium ion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:137983 name: methylated tertiary amine subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:137984 name: methylated secondary ammonium ion subset: chebi_ph7_3 is_a: CHEBI:137982 ! tertiary ammonium ion [Term] id: CHEBI:137986 name: (beta-Asp-Arg)n zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:137987 name: 19-hydroxyprostaglandin I2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:137990 name: (beta-Asp-Arg)n-Asp(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:137991 name: beta-Asp-Arg zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:137994 name: (2E)-2-ethylidene-4-hydroxy-5-methyl-3(2H)-furanone subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33823 ! enol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:137995 name: 2-ethyl-4-hydroxy-5-methyl-3(2H)-furanone subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33823 ! enol is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:137996 name: O-[S-(gamma-L-glutamyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:137997 name: O-[S-4-(aminobutanoyl)pantetheine-4'-phosphoryl]serine zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:137998 name: O-\{S-[4-(gamma-L-glutamylamino)butanoyl]pantetheine-4'-phosphoryl}serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:137999 name: O-[S-4-(gamma-L-glutamylamino)-(2S)-2-hydroxybutanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138000 name: 3-(1-methylpyrrolidin-2-yl)pyridine is_a: CHEBI:26416 ! pyridine alkaloid is_a: CHEBI:26456 ! pyrrolidine alkaloid is_a: CHEBI:46775 ! N-alkylpyrrolidine [Term] id: CHEBI:138007 name: N-acetyl-alpha-D-hexosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58881 ! N-acetyl-D-hexosamine 1-phosphate(2-) [Term] id: CHEBI:138011 name: 6-(alpha-D-glucose-1-phospho)-alpha-D-mannoside(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138015 name: endocrine disruptor is_a: CHEBI:51061 ! hormone receptor modulator [Term] id: CHEBI:138019 name: N(6)-propanoyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:138020 name: alpha-D-mannosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:138021 name: (3S)-3-hydroxy-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138024 name: alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:138025 name: N-acetyl-beta-D-glucosaminyl-(1->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:138026 name: 5alpha-dihydrotestosterone sulfate is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:16158 ! steroid sulfate relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:138027 name: N-acetyl-beta-D-galactosaminyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:138029 name: 14alpha-methyl steroid subset: chebi_ph7_3 is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:138031 name: Delta(14) steroid subset: chebi_ph7_3 is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:138032 name: (3beta,5alpha,17beta)-3-hydroxyandrostan-17-yl sulfate is_a: CHEBI:131647 ! androstane sulfate is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:138034 name: dTDP-4-formamido-4,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:138035 name: S-mycothiol-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138037 name: 10-epi-juneol subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:62508 ! eudesmane sesquiterpenoid [Term] id: CHEBI:138039 name: (3E,7E)-dolathalia-3,7,11-triene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138040 name: 7-epi-alpha-eudesmol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:62508 ! eudesmane sesquiterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138041 name: (+)-4-epi-cubebol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:138042 name: tau-cadinol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:22975 ! cadinane sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138043 name: (2E,6E)-hedycaryol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:68588 ! germacrane sesquiterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138044 name: (2Z,6E)-hedycaryol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:68588 ! germacrane sesquiterpenoid [Term] id: CHEBI:138045 name: (-)-10-epi-cubebol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:138046 name: sesterfisherol subset: chebi_ph7_3 is_a: CHEBI:134397 ! tertiary allylic alcohol is_a: CHEBI:26660 ! sesterterpenoid is_a: CHEBI:35294 ! carbopolycyclic compound [Term] id: CHEBI:138047 name: beta-thujene subset: chebi_ph7_3 is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:50030 ! thujene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138048 name: stellata-2,6,19-triene subset: chebi_ph7_3 is_a: CHEBI:35192 ! sesterterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:138049 name: guaia-4,6-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138050 name: pseudolaratriene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138051 name: selina-4(15),7(11)-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138052 name: (3S)-3,4-dihydroxy-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138053 name: 5-methoxycarbonylmethoxyuridine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:138054 is_obsolete: true replaced_by: CHEBI:138803 [Term] id: CHEBI:138055 name: 2,4,5-trihydroxyphenylacetic acid is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:25978 ! phenylacetic acids relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:138056 name: 2,4,5-trihydroxyphenylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:138057 name: N-terminal L-alanyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138058 name: N-terminal N-methyl-L-alanyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138059 name: N-terminal L-prolyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138060 name: N-terminal N-methyl-L-prolyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138061 name: N-terminal L-seryl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138062 name: N-terminal N-methyl-L-seryl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138063 name: coelenterazine h dioxetanone subset: chebi_ph7_3 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:33853 ! phenols is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:38314 ! pyrazines is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:138067 name: N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138068 name: ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:138075 name: 5-formyl CMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138076 name: 1,1'-dihydroxyneurosporene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:23824 ! diol is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:138077 name: chloroxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138078 name: 5'-(N(2),N(7)-dimethyl 5'-triphosphoguanosine)-(purine ribonucleotide)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:172880 ! 5'-(N(2),N(7)-dimethyl 5'-triphosphoguanosine)-ribonucleoside(2-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138079 name: 5'-(N(2),N(2),N(7)-trimethyl 5'-triphosphoguanosine)-(purine ribonucleotide)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138087 name: O-acyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:138088 name: long chain primary alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:138092 name: 1-[(Z)-alk-1-enyl]-sn-glycero-3-phospho-(N-acyl)ethanolamine is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:138093 name: N-acyl-aromatic L-alpha-amino-acid anion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:138094 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-hexadecanoyl)ethanolamine is_a: CHEBI:138092 ! 1-[(Z)-alk-1-enyl]-sn-glycero-3-phospho-(N-acyl)ethanolamine [Term] id: CHEBI:138095 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-oleoyl)ethanolamine is_a: CHEBI:138092 ! 1-[(Z)-alk-1-enyl]-sn-glycero-3-phospho-(N-acyl)ethanolamine [Term] id: CHEBI:138096 name: 1-(1Z-octadecenyl)-sn-glycero-3-phospho-(N-arachidonoyl)ethanolamine is_a: CHEBI:138092 ! 1-[(Z)-alk-1-enyl]-sn-glycero-3-phospho-(N-acyl)ethanolamine [Term] id: CHEBI:138097 name: 1-(1Z-octadecenyl)-sn-glycero-3-phosphate is_a: CHEBI:73423 ! 1-(alk-1-enyl)-sn-glycero-3-phosphate [Term] id: CHEBI:138098 name: 2-[(9S,11R)-epidioxy-(15S)-hydroperoxy-(5Z,13E)-prostadienoyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:167121 ! oxidized 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:138099 name: 2-[(9S,11R)-epidioxy-(15S)-hydroxy-(5Z,13E)-prostadienoyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:167121 ! oxidized 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:138100 name: 2-[(9S,11R)-epidioxy-(15S)-hydroperoxy-(5Z,13E)-prostadienoyl]-sn-glycero-3- phosphocholine subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138101 name: 2-[(9S,11R)-epidioxy-(15S)-hydroxy-(5Z,13E)-prostadienoyl]-sn-glycero-3- phosphocholine subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:167119 ! oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138102 name: 4-(ADP-D-ribosyl)-L-aspartyl(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138103 name: inorganic acid is_a: CHEBI:39141 ! Bronsted acid [Term] id: CHEBI:138105 name: (S)-6-acetamido-3-aminohexanoic acid is_a: CHEBI:2164 ! 6-acetamido-3-aminohexanoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138107 name: (3S)-3-hydroxy-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:141828 ! 3-hydroxy-L-asparagine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138109 name: alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:138110 name: 16(S)-HETE is_a: CHEBI:63994 ! 16-HETE relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138111 name: (3S)-3-hydroxy-L-aspartate residue subset: chebi_ph7_3 is_a: CHEBI:17427 ! 3-hydroxy-L-aspartate residue [Term] id: CHEBI:138112 name: chondroitin 4',6'-disulfate anion subset: chebi_ph7_3 is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:138113 name: O-adenyl-L-threonine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:138114 name: O-guanylyl-L-tyrosine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:138121 name: dermatan 4',6'-disulfate anion subset: chebi_ph7_3 is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:138130 name: Delta(7)-sterol subset: chebi_ph7_3 is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:138131 name: Delta(5),Delta(7)-sterol subset: chebi_ph7_3 is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:138135 name: (13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid is_a: CHEBI:138146 ! 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:138138 name: epoxy(hydroxy)icosatrienoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:61703 ! nonclassic icosanoid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:138139 name: 2,3-bis-O-phytanyl-sn-glycerol 1-phospholipid anion subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138140 name: 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid anion subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138141 name: 17alpha-hydroxy-C21-steroid subset: chebi_ph7_3 is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:138142 name: 21-hydroxy-C21-steroid subset: chebi_ph7_3 is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:138145 name: 1,2-di-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:71713 ! phosphatidylethanolamine 32:2 [Term] id: CHEBI:138146 name: 13-hydroxy-14,15-epoxy-(5Z,8Z,11Z)-icosatrienoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:138147 name: 3'-end deoxyribonucleotide 3'-phosphate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138148 name: 3'-end deoxyribonucleotide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138150 name: D-tagatopyranose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138165 name: (+)-(2S,3R,9R)-pristinol subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138166 name: nezukol subset: chebi_ph7_3 is_a: CHEBI:138429 ! isopimarane diterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138167 name: 5-hydroxy-alpha-gurjunene subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:138171 name: pApA(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138175 name: O-[S-(L-alpha-aminoacyl)pantetheine-4'-phosphoryl]serine zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:138176 name: (2R,3S,4S)-leucoanthocyanidin subset: chebi_ph7_3 is_a: CHEBI:60835 ! leucoanthocyanidin [Term] id: CHEBI:138177 name: 4-unsubstituted 3-hydroxyanthocyanidin betaine subset: chebi_ph7_3 is_a: CHEBI:134087 ! 3-hydroxyanthocyanidin betaine [Term] id: CHEBI:138178 name: (4S)-2,3-dehydroflavan-3,4-diol(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:138188 name: (2R,3R)-dihydroflavonol subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:48039 ! dihydroflavonols [Term] id: CHEBI:138191 name: 3'-end 3'-(N-acyl-L-alpha-aminoacyl)adenylyl(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138193 name: (2R,5S)-2,5-diaminohexanoic acid is_a: CHEBI:35987 ! diamino acid [Term] id: CHEBI:138194 name: 1,2-dihexanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:134298 ! phosphatidylcholine 12:0 relationship: has_role CHEBI:35195 ! surfactant [Term] id: CHEBI:138195 name: 1,2-diheptanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:137852 ! phosphatidylcholine 14:0 relationship: has_role CHEBI:27780 ! detergent [Term] id: CHEBI:138196 name: 19-hydroxyleukotriene B4 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:138197 name: 1-hexanoyl-2-heptanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:134299 ! phosphatidylcholine 13:0 is_a: CHEBI:137403 ! 1-hexanoyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:138198 name: 1-heptanoyl-2-hexanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:134299 ! phosphatidylcholine 13:0 [Term] id: CHEBI:138199 name: 1-hexadecanoyl-2-heptanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:77369 ! 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:138200 name: 1-heptanoyl-2-hexadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:138201 name: 18-hydroxyleukotriene B4 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:138202 name: (13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:138206 name: (13R)-S-cysteinylglycinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:138208 name: carotenoid biosynthesis inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:138209 name: (13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:47910 ! S-substituted L-cysteine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:138211 name: 1-octadecanoyl-2-pentanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:138212 name: 1-octadecanoyl-2-hexanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:85564 ! phosphatidylcholine 24:0 [Term] id: CHEBI:138216 name: 1,2-dihexanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:138217 name: 1-heptanoyl-2-hexanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:138218 name: 1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71718 ! phosphatidylethanolamine 34:0 zwitterion [Term] id: CHEBI:138219 name: ent-atiserene subset: chebi_ph7_3 is_a: CHEBI:33666 ! polycyclic hydrocarbon is_a: CHEBI:35190 ! diterpene is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138220 name: N-hexadecanoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:78085 ! N-hexadecanoylphosphatidylethanolamine(1-) [Term] id: CHEBI:138221 name: CDP-D-ribulose is_a: CHEBI:20873 ! CDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:138222 name: N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:137429 ! N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:138223 name: ent-copal-8-ol diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138224 name: (13R)-epi-8,13-epoxylabd-14-ene subset: chebi_ph7_3 is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:138225 name: CDP-D-ribose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:138226 name: beta-geranylfarnesene subset: chebi_ph7_3 is_a: CHEBI:35192 ! sesterterpene is_a: CHEBI:48121 ! polyene relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138227 name: beta-hexaprene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:48121 ! polyene relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138228 name: beta-heptaprene subset: chebi_ph7_3 is_a: CHEBI:48121 ! polyene is_a: CHEBI:64804 ! sesquarterpene relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138229 name: N-acetyl-alpha-D-muramic acid 1-phosphate is_a: CHEBI:25432 ! muramic acids is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:138232 name: peregrinol diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138233 name: 9,13(R)-epoxylabd-14-ene subset: chebi_ph7_3 is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138234 name: (13R)-manoyl oxide subset: chebi_ph7_3 is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138237 name: 2-hydroxy-7,8-dihydropteroic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:38795 ! pteroic acids relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:138238 name: pyrimidine ribonucleoside 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) [Term] id: CHEBI:138239 name: N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:138247 name: cycloaraneosene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:51959 ! organic tricyclic compound is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:138255 name: (9S,10R)-9,10-epoxy-18-hydroxyoctadecanoic acid is_a: CHEBI:133381 ! 9,10-epoxy-18-hydroxyoctadecanoic acid [Term] id: CHEBI:138256 name: N-(4-oxoglutaryl)-L-cysteinylglycine(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:138258 name: (9R,10S)-9,10-epoxy-18-hydroxyoctadecanoic acid is_a: CHEBI:133381 ! 9,10-epoxy-18-hydroxyoctadecanoic acid [Term] id: CHEBI:138260 name: (9R,10S)-9,10-epoxyoctadecanoic acid is_a: CHEBI:82464 ! cis-9,10-epoxyoctadecanoic acid [Term] id: CHEBI:138261 name: very long-chain fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138262 name: (9S,10R)-epoxyoctadecanoic acid is_a: CHEBI:82464 ! cis-9,10-epoxyoctadecanoic acid [Term] id: CHEBI:138265 name: 9,10-epoxy-18-hydroxy-(12Z)-octadecenoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:138266 name: 2-heptanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:138267 name: hexanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:138268 name: D-xylulose 1,5-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138269 name: 1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine(1-) subset: chebi_ph7_3 is_a: CHEBI:167120 ! oxidized 1-O-alkyl-2-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138270 name: 12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:138272 name: 8,9-epoxy-20-hydroxy-(5Z,11Z,14Z)-icosatrienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid [Term] id: CHEBI:138273 name: 11,12-epoxy-20-hydroxy-(5Z,8Z,14Z)-icosatrienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid [Term] id: CHEBI:138274 name: 14,15-epoxy-20-hydroxy-(5Z,8Z,11Z)-icosatrienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid [Term] id: CHEBI:138275 name: oxidized Renilla luciferin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:138276 name: 5'-end purine ribonucleoside 5'-diphosphate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:167616 ! 5'-end ribonucleoside 5'-diphosphate(3-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138278 name: 5'-end GTP-ribonucleotide(5-) residue subset: chebi_ph7_3 is_a: CHEBI:141855 ! 5'-end NTP-ribonucleotide(5-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138279 name: 7-oxoresolvin D2 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:23824 ! diol is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138280 name: adenosine-5'-diphospho-5'-ribonucleotide(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138281 name: 16-oxoresolvin D2 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:23824 ! diol is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138282 name: 5'-end ribonucleotide(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138284 name: 5'-end ribonucleoside residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:138286 name: N-terminal N,N-dimethyl-L-alanyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138288 name: 5'-end purine ribonucleotide 5'-triphosphate(4-) residue subset: chebi_ph7_3 is_a: CHEBI:167618 ! 5'-end ribonucleotide 5'-triphosphate(4-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138290 name: 2-hydroxyoctanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138291 name: (5S,15S)-dihydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid is_a: CHEBI:138293 ! bis(hydroperoxy)icosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:138292 name: 2-hydroxydecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138293 name: bis(hydroperoxy)icosatetraenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:138294 name: N(epsilon)-(5'-guanylyl)-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:138295 name: (5S,6R)-dihydroxy-(7E,9E,11Z,14Z)-icosatetraenoic acid is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid [Term] id: CHEBI:138296 name: 2-hydroxyisovaleryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:58783 ! 2-hydroxy-3-methylacyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138297 name: 2-hydroxyheptadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138298 name: 2-hydroxyicosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138299 name: 2-hydroxydodecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138300 name: 2-hydroxytetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138301 name: labda-7,13(16),14-triene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:138302 name: (12E)-labda-8(17),12,14-triene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:138303 name: alpha-onocerin subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138305 name: (21S)-21,22-epoxypolypoda-8(26)-13,17-trien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138306 name: aromatic (S)-hydroxynitrile subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin is_a: CHEBI:33655 ! aromatic compound [Term] id: CHEBI:138307 name: (3S,22S)-2,3:22,23-diepoxy-2,3,22,23-tetrahydrosqualene subset: chebi_ph7_3 is_a: CHEBI:26747 ! squalene triterpenoid is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138309 name: C-terminal L-alpha-amino-acid-L-tyrosinate residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:138310 name: (-)-kolavenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138311 name: (+)-kolavenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138313 name: (+)-kolavelool subset: chebi_ph7_3 is_a: CHEBI:134397 ! tertiary allylic alcohol is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:138314 name: S-allylsulfenic acid subset: chebi_ph7_3 is_a: CHEBI:22326 ! S-alkylsulfenic acid relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138315 name: N-terminal N,N,N-trimethyl-L-alanyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138316 name: N-terminal N,N-dimethyl-L-seryl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138317 name: N-terminal N,N,N-trimethyl-L-seryl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138318 name: N-terminal N,N-dimethyl-L-prolyl-L-prolyl-L-lysyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:134400 ! cationic peptidyl group [Term] id: CHEBI:138319 name: monoalk-1-enyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:138320 name: monoalkyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:138321 name: O-[S-(4-hydroxybenzoyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138325 name: (5S)-hydroxy-(15S)-hydroperoxy-(6E,8Z,11Z,13E)-icosatetraenoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:138327 ! hydroperoxy(hydroxy)icosatetraenoic acid [Term] id: CHEBI:138326 name: (5S,6R)-dihydroxy-(15S)-hydroperoxy-(7E,9E,11Z,13E)-icosatetraenoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:138327 ! hydroperoxy(hydroxy)icosatetraenoic acid is_a: CHEBI:23824 ! diol [Term] id: CHEBI:138327 name: hydroperoxy(hydroxy)icosatetraenoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:138328 name: L-firefly luciferyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:138329 name: ent-Photinus luciferin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:138330 name: pyridinium-3-carboxylate-5-thiocarboxylate mononucleotide(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:84291 ! organic sulfur anion [Term] id: CHEBI:138331 name: cholesteryl icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:138332 name: 11(S)-HETE is_a: CHEBI:72606 ! 11-HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:138334 name: N(tele)-(N(7)-methylguanosine 5'-phosphonato)-L-histidine zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:138339 name: 2-[(11R)-hydroxy-(5Z,8Z,12E,14Z)-icosatetraenoyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:138340 name: (2R,3S)-2-alkyl-3-hydroxyalkanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:138341 name: (R)-2-alkyl-3-oxoalkanoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:138346 name: triacylglycerol 54:9 subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:138347 name: triacylglycerol 54:0 subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:138358 name: 4-sulfanylbutanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:138359 name: 4,4'-disulfanyldibutanoate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:138361 name: 2-[(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dien-1-oyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138362 name: (4S,7R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:82207 ! (4S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:138363 name: (4R,7S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:82204 ! (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:138365 name: allo-bile acid is_a: CHEBI:138366 ! bile acids is_a: CHEBI:36246 ! 5alpha-cholanic acids [Term] id: CHEBI:138366 name: bile acids is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35350 ! hydroxy steroid is_a: CHEBI:36078 ! cholanoid [Term] id: CHEBI:138369 name: [4)-beta-D-GlcA-(1->4)-beta-D-GlcA2(or 3)Ac-(1->4)-beta-D-Glc-(1->4)-[(R)-4,6-CH3(COO(-))C-beta-D-Gal3(or 2)OHb-(1->3)-beta-D-Glc-(1->4)-beta-D-Glc-(1->4)-beta-D-Glc-(1->6)]-alpha-DGlc2(or 3)Ac-(1->]n subset: chebi_ph7_3 is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:138370 name: N(6)-(gamma-glutamyl)lysine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138371 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63567 ! tetrasaccharide derivative [Term] id: CHEBI:138372 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63566 ! pentasaccharide derivative [Term] id: CHEBI:138373 name: 4-methylpent-3-en-1-yl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:138374 name: N-(12-hydroxyjasmonyl)-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:138375 name: (1E)-2,6-dimethylhepta-1,5-dien-1-yl formate subset: chebi_ph7_3 is_a: CHEBI:52343 ! formate ester is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:138376 name: allocholoyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:138377 name: allodeoxycholoyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:138378 name: beta-muricholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:138379 name: ursodeoxycholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:138383 name: (4S,7R)-7-isopropyl-4-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:50243 ! 7-isopropyl-4-methyloxepan-2-one [Term] id: CHEBI:138384 name: 7-oxotaurolithocholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:138385 name: N(omega)-(2'-phospho-ADP-D-ribosyl)-L-arginine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:138386 name: TDP-alpha-D-glucose is_a: CHEBI:22080 ! TDP-sugar [Term] id: CHEBI:138388 name: 4-methylpent-3-en-1-ol subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138389 name: 7,12-dioxolithocholic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:48070 ! 12-oxo steroid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138390 name: EC 1.1.1.159 (7alpha-hydroxysteroid dehydrogenase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:138391 name: 7-oxoglycolithocholic acid is_a: CHEBI:36255 ! bile acid glycine conjugate is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:138392 name: hydroperoxyicosapentaenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:138393 name: 7-oxotaurodeoxycholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:138394 name: 7-oxoglycodeoxycholic acid is_a: CHEBI:36255 ! bile acid glycine conjugate is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:138396 name: OPC8-CoA (4-) subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:138397 name: octahydronaphthalenes is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:138398 name: (15Z)-12-oxophyto-10,15-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138399 name: 7beta-hydroxy-3,12-dioxo-5beta-cholanic acid is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:48070 ! 12-oxo steroid [Term] id: CHEBI:138400 name: 4-sulfanylbutanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:138401 name: 3alpha,7beta-dihydroxy-12-oxo-5beta-cholanic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:48070 ! 12-oxo steroid [Term] id: CHEBI:138402 name: 4,4'-disulfanyldibutanoic acid is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:138403 name: O-[S-(2E,9Z)-hexadecadienoylpantetheine-4'-phosphoryl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:138404 name: (E)-hex-4-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138405 name: O-(S-(7Z)-tetradecenoylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138406 name: O-\{S-[(9Z)-3-oxohexadecenoylpantetheine]-4'-phosphoryl}-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:138407 name: O-[S-(3R)-hydroxy-(9Z)-hexadecenoylpantetheine-4'-phosphoryl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138408 name: isoprostane is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:138429 name: isopimarane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:138430 name: (9R,13R)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoate subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:138431 name: (9S,13S)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138432 name: 6-\{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoate subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:138433 name: (9S,13S)-1a,1b-dinor-12-oxo-10,15-phytodienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:138434 name: 6-\{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35744 ! carbocyclic fatty acid is_a: CHEBI:51689 ! enone is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:138436 name: hexadecanoyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59918 ! acyl monophosphate(2-) [Term] id: CHEBI:138437 name: (S)-3-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:138439 name: [alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138440 name: (3R,4R)-3-[(1S)-1-hydroxyalkyl]-4-(hydroxymethyl)oxolan-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:138441 name: (3R,4R)-3-acyl-4-(hydroxymethyl)oxolan-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:17087 ! ketone is_a: CHEBI:22950 ! butan-4-olide [Term] id: CHEBI:138442 name: O(3)-(beta-D-GlcA-(1->3)-beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:138443 name: O(3)-(beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:138444 name: O(3)-(beta-D-GlcA-(1->3)-poly[beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)]-beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine polyanionic residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:138445 name: O(3)-(poly[beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)]-beta-D-GalNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Xyl)-L-serine polyanionic residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:138461 name: (3R)-3-hydroxy-2,3-dihydrotabersoninium subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:138462 name: (3R)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:138463 name: N-(12-oxojasmonyl)-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:138464 name: N-(12-hydroxy-12-oxojasmonyl)-L-alpha-amino acid dianion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:138473 name: N(2)-[(3R)-3-(2-saturated-acyloxy)acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:140663 ! N(2)-[(3R)-3-(acyloxy)acyl]-L-ornithine zwitterion [Term] id: CHEBI:138478 name: N(5)-methyl-N(2)-[(3R)-3-(acyloxy)acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:138480 name: N(5),N(5)-dimethyl-N(2)-[(3R)-3-(acyloxy)acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:138481 name: N(5),N(5),N(5)-trimethyl-N(2)-[(3R)-3-(acyloxy)acyl]-L-ornithine betaine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine [Term] id: CHEBI:138482 name: N(2)-[(3R)-hydroxy-acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:138483 name: cis-3,4-dialkyloxetan-2-one subset: chebi_ph7_3 is_a: CHEBI:38784 ! oxetanes is_a: CHEBI:49043 ! beta-lactone [Term] id: CHEBI:13850 name: apoprotein is_a: CHEBI:38560 ! simple protein relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:138518 name: dialkyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138532 name: lysophosphatidylethanolamine 17:0 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:138538 name: O-\{S-[3-oxo-(11Z)-octadecenoyl]pantetheine-4'-phosphoryl}-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:138558 name: (3E,5Z)-dodecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:85110 ! (3E,5Z)-dienoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138560 name: 5-amino-1-(5-phospho-beta-D-ribosyl)imidazole is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:37292 ! 1-(phosphoribosyl)imidazole relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138569 name: (3E,5Z)-dodecadienoate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:138582 name: 19-hydroxyprostaglandin I2 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26345 ! prostaglandins I is_a: CHEBI:27136 ! triol is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138587 name: (R)-3-hydroxypentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138609 ! short-chain (R)-3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:138588 name: (R)-3-hydroxypentanoate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:85634 ! (3R)-3-hydroxy fatty acid anion [Term] id: CHEBI:138589 name: pneumocysterol subset: chebi_ph7_3 is_a: CHEBI:138029 ! 14alpha-methyl steroid is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:138595 name: O-phosphocholine-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:138596 name: (4S,7S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:82207 ! (4S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:138597 name: (4R,7R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:82204 ! (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:138599 name: 4,4'-diapolycopen-4-al subset: chebi_ph7_3 is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:138600 name: 4,4'-diapolycopen-4-oate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:138603 name: (4-alkanoyl-5-oxo-2,5-dihydrofuran-3-yl)methyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138604 name: [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138603 ! (4-alkanoyl-5-oxo-2,5-dihydrofuran-3-yl)methyl phosphate(2-) [Term] id: CHEBI:138605 name: [(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138621 ! [(3S,4R)-4-alkanoyl-5-oxooxolan-3-yl]methyl phosphate(2-) [Term] id: CHEBI:138607 name: (S)-3-hydroxypentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136760 ! short-chain (3S)-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:138608 name: (S)-3-hydroxypentanoate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:138609 name: short-chain (R)-3-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:138610 name: O-[S-(2E)-isoheptenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:138611 name: O-[S-(isoheptanoyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138619 name: D-alanyl-AMP zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:13862 name: asparagusate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:39192 ! dithiolanes [Term] id: CHEBI:138620 name: O-[S-(D-alanyl)pantetheine-4'-phosphoryl]-L-serine zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:138175 ! O-[S-(L-alpha-aminoacyl)pantetheine-4'-phosphoryl]serine zwitterionic residue [Term] id: CHEBI:138621 name: [(3S,4R)-4-alkanoyl-5-oxooxolan-3-yl]methyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138622 name: O-(S-L-prolylpantetheine-4'-phosphoryl)serine zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:138175 ! O-[S-(L-alpha-aminoacyl)pantetheine-4'-phosphoryl]serine zwitterionic residue [Term] id: CHEBI:138623 name: O-[S-(pyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138625 name: (+)-jasmonic acid anion subset: chebi_ph7_3 is_a: CHEBI:136184 ! jasmonic acid anion [Term] id: CHEBI:138626 name: N-[(3R)-12-hydroxyjasmonyl]-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:136183 ! N-jasmonyl-L-alpha-amino acid anion [Term] id: CHEBI:138627 name: N-[(3R)-jasmonyl]-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:136183 ! N-jasmonyl-L-alpha-amino acid anion [Term] id: CHEBI:138628 name: 2-hydroxybutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) [Term] id: CHEBI:138630 name: 2-hydroxyhexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138631 name: heptadecanal subset: chebi_ph7_3 is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84587 ! 2,3-saturated fatty aldehyde relationship: has_role CHEBI:76498 ! coral metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138632 name: 2-hydroxy-3-methylundecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138633 name: 2-hydroxy-3-methylnonanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138634 name: 3-methylnonanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83968 ! 3-methyl fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138635 name: (R)-2-hydroxyhexadecanal subset: chebi_ph7_3 is_a: CHEBI:50626 ! 2-hydroxyhexadecanal [Term] id: CHEBI:138636 name: 2-hydroxy-3-methyldodecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138637 name: 3-methyldodecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83968 ! 3-methyl fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138640 name: 17(S)-HDoHE is_a: CHEBI:72637 ! (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138651 name: O-(S-fatty acylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:138654 name: (R)-2-hydroxyhexadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:138656 name: rhizathalene A subset: chebi_ph7_3 is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:35190 ! diterpene is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:138657 name: 6-(alpha-D-glucose-1-phospho)-alpha-D-mannoside is_a: CHEBI:16326 ! alpha-D-hexose 1-phosphate is_a: CHEBI:27535 ! alpha-D-mannoside is_a: CHEBI:37549 ! glycoside phosphate [Term] id: CHEBI:138658 name: dilinoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride is_a: CHEBI:51307 ! diester [Term] id: CHEBI:138660 name: dTDP-4-formamido-4,6-dideoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:138661 name: N-hexadecanoyl-O-(1-octadecanoyl-2-oleoyl-sn-glycero-3-phospho)-L-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:157757 ! 1,2-diacyl-sn-glycero-3-phospho-(N-acyl)-serine(2-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138662 name: N-hexadecanoyl-O-(1-octadecanoyl-sn-glycero-3-phospho)-L-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:157758 ! 1-acyl-2-hydroxy-sn-glycero-3-phospho-(N-acyl)-serine(2-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138663 name: N-hexadecanoyl-1-[(1Z)-octadecenoyl]-2-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:140451 ! N-acyl-1-[(1Z)-alkenyl]-2-acyl-sn-glycero-3-phosphoethanolamine(1-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:138664 name: N-(omega-hydroxytriacontanoyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:144784 ! omega-hydroxy-ultra-long chain fatty acylceramide is_a: CHEBI:157663 ! N-(omega-hydroxy-ultra-long chain fatty acyl)sphingosine is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:138675 name: gas molecular entity is_a: CHEBI:33579 ! main group molecular entity [Term] id: CHEBI:138676 name: 11-cis-retinyl tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester is_a: CHEBI:195358 ! 11-cis-retinyl ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:138691 name: 9-cis-retinyl tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester is_a: CHEBI:195360 ! 9-cis-retinyl ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:1387 name: 3,4-dihydroxyphenylethyleneglycol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:33573 ! tetrol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:138704 name: 13-cis-retinyl tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester is_a: CHEBI:195359 ! 13-cis-retinyl ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:138718 name: all-trans-retinyl tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:63410 ! all-trans-retinyl ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138721 name: tetradecyl tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:138722 name: 13-cis-retinyl hexadecanoate subset: chebi_ph7_3 is_a: CHEBI:15040 ! retinyl palmitate is_a: CHEBI:195359 ! 13-cis-retinyl ester [Term] id: CHEBI:138723 name: 1-oleoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:138724 name: all-trans-retinyl heptanoate subset: chebi_ph7_3 is_a: CHEBI:63410 ! all-trans-retinyl ester [Term] id: CHEBI:138726 name: 3'-unsubstituted flavone subset: chebi_ph7_3 is_a: CHEBI:24043 ! flavones [Term] id: CHEBI:138730 name: 3'-methoxyflavones subset: chebi_ph7_3 is_a: CHEBI:25241 ! methoxyflavone [Term] id: CHEBI:138731 name: 5'-hydroxy-3'-methoxyflavone subset: chebi_ph7_3 is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:71968 ! hydroxyflavonoid [Term] id: CHEBI:138732 name: 3',5'-dimethoxyflavone subset: chebi_ph7_3 is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:23798 ! dimethoxyflavone [Term] id: CHEBI:138733 name: alpha-D-galactosyl ditrans,octacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:138734 name: 1-[(9Z)-octadecenyl]monooleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:76582 ! monoalkylmonoacylglycerol [Term] id: CHEBI:138735 name: 1-[(9Z)-octadecenyl]-2,3-dioleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:36727 ! 1-alkyl-2,3-diacylglycerol [Term] id: CHEBI:138744 name: 2-[(9S,11R)-epidioxy-(15S)-hydroperoxy-(5Z,13E)-prostadienoyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138745 name: 2-[(9S,11R)-epidioxy-(15S)-hydroxy-(5Z,13E)-prostadienoyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26347 ! prostanoid is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138792 name: 1,2-di-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:136471 ! phosphatidylethanolamine (16:1/16:1) [Term] id: CHEBI:138801 name: D-tagatopyranose 1-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:138803 name: archaeosine 5'-phosphate zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:138807 name: ent-copal-8-ol diphosphate is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:138808 name: CDP-4-dehydro-6-deoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:58166 ! CDP-4-dehydro-6-deoxy-D-glucose(2-) [Term] id: CHEBI:138809 name: (3R)-3-hydroxy-4-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:71944 ! aldehydic acid anion [Term] id: CHEBI:138842 name: 3alpha-hydroxy bile acid CoA thioester(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:138843 name: 3-oxo bile acid CoA thioester(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:138880 name: autophagy inducer is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:138881 name: beta-D-fructofuranose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58674 ! D-fructofuranose 1-phosphate(2-) [Term] id: CHEBI:138888 name: (R)-3-hydroxy-4-oxobutanoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:50413 ! hydroxyaldehyde [Term] id: CHEBI:138890 name: peregrinol diphosphate is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:138893 name: Man-1-6-Ins-1-P-Cer(d18:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:139065 ! mannosylinositol-1-phosphodihydroceramide(1-) is_a: CHEBI:167047 ! mannosyl-alpha-1->6-inositol-1-phosphodihydroceramide(1-) [Term] id: CHEBI:138897 name: 3',5'-unsubstituted flavanone subset: chebi_ph7_3 is_a: CHEBI:28863 ! flavanones [Term] id: CHEBI:138919 name: meso-zeaxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:138922 name: 1,2-dihexanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:138923 name: 1-heptanoyl-2-hexanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:138926 name: 1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:138929 name: N-hexadecanoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:78929 ! N-hexadecanoylphosphatidylethanolamine [Term] id: CHEBI:138930 name: N-oleoyl-1,2-diheptadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:138239 ! N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:138934 name: N-(4-oxoglutaryl)-L-cysteinylglycine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:138936 name: N(6)-hexadecanoyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue is_a: CHEBI:189854 ! N(6)-(fatty acyl)-L-lysine residue [Term] id: CHEBI:138937 name: D-xylulose 1,5-bisphosphate is_a: CHEBI:27355 ! xylulose phosphate relationship: has_role CHEBI:138938 ! EC 4.1.1.39 (ribulose-bisphosphate carboxylase) inhibitor [Term] id: CHEBI:138938 name: EC 4.1.1.39 (ribulose-bisphosphate carboxylase) inhibitor is_a: CHEBI:76906 ! EC 4.1.1.* (carboxy-lyase) inhibitor [Term] id: CHEBI:138940 name: 1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:71554 ! PPARgamma agonist [Term] id: CHEBI:138941 name: 2-hydroxyoctanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:138942 name: 11-hydroxyferruginol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138943 name: carnosate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:138944 name: salviol subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138945 name: maniladiol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25872 ! pentacyclic triterpenoid relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138946 name: cochalate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:138948 name: (4S)-2,3-dehydroleucocyanidin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:138950 name: (4S)-2,3-dehydroleucopelargonidin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:138951 name: 3'-hydroxy-5'-unsubstituted flavanone subset: chebi_ph7_3 is_a: CHEBI:48024 ! 3'-hydroxyflavanones [Term] id: CHEBI:138955 name: daturadiol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25872 ! pentacyclic triterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138959 name: 2-hydroxydecanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:138961 name: sugiol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138962 name: 11-hydroxysugiol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:37733 ! EC 3.1.1.8 (cholinesterase) inhibitor relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138963 name: 11,20-dihydroxysugiol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33566 ! catechols is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138964 name: 2-hydroxyisovaleryl-CoA is_a: CHEBI:49173 ! 2-hydroxy-3-methylacyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:138965 name: 11,20-dihydroxyferruginol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33566 ! catechols is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138966 name: 9beta-pimara-7,15-diene-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:49192 ! pimarane diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138967 name: ent-cassa-12,15-dien-2beta-ol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138968 name: ent-cassa-12,15-dien-2beta,3beta-diol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138969 name: ent-cassa-12,15-dien-2-one subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138970 name: ent-3beta-hydroxycassa-12,15-dien-2-one subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138971 name: drimendiol subset: chebi_ph7_3 is_a: CHEBI:134361 ! allylic alcohol is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26658 ! sesquiterpenoid relationship: has_role CHEBI:138977 ! quorum sensing inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138972 name: 11alpha-hydroxycucurbitadienol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138973 name: 11-oxocucurbitadienol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138974 name: mogrol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36853 ! hydroxy seco-steroid relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:138975 name: mogroside IE subset: chebi_ph7_3 is_a: CHEBI:139477 ! mogroside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:138977 name: quorum sensing inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:138979 name: hemisuccinate is_a: CHEBI:36181 ! succinate ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:138980 name: AZD1979(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:139155 ! melanin-concentrating hormone receptor antagonist [Term] id: CHEBI:139019 name: AZD1979 oxetane hydrolysis product subset: chebi_ph7_3 is_a: CHEBI:140326 ! tertiary carboxamide is_a: CHEBI:23824 ! diol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:46685 ! oxadiazole is_a: CHEBI:46959 ! N-acylazetidine [Term] id: CHEBI:139020 name: taurino group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:139021 name: cis-alkene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:139022 name: 2-hydroxyheptadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:139023 name: 2-hydroxyicosanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:139024 name: 2-hydroxydodecanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139025 name: 2-hydroxytetradecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:139032 name: nerylneryl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139033 name: (-)-kolavenyl diphosphate is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:36772 ! diterpenyl phosphate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:139034 name: (+)-kolavenyl diphosphate is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:139035 name: L-firefly luciferyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:139036 name: ent-Photinus luciferin is_a: CHEBI:37947 ! benzothiazoles is_a: CHEBI:48652 ! 1,3-thiazolemonocarboxylic acid is_a: CHEBI:83991 ! imidothioate relationship: has_role CHEBI:25078 ! luciferin relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:139048 name: dihydroceramide subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:139051 name: phytoceramide subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid is_a: CHEBI:84403 ! phytoceramides [Term] id: CHEBI:139052 name: inositol-1-phosphodihydroceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64916 ! inositol phosphoceramide(1-) [Term] id: CHEBI:139053 name: inositol-1-phosphophytoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64916 ! inositol phosphoceramide(1-) [Term] id: CHEBI:139057 name: pyridinium-3-carboxy-5-thiocarboxylic acid mononucleotide is_a: CHEBI:17188 ! nucleoside 5'-monophosphate is_a: CHEBI:35737 ! monothiocarboxylic acid is_a: CHEBI:36980 ! pyridine nucleotide [Term] id: CHEBI:139064 name: (15Z)-12-oxophyto-10,15-dienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61903 ! oxo-fatty acyl-CoA [Term] id: CHEBI:139065 name: mannosylinositol-1-phosphodihydroceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64997 ! mannosylinositol phosphorylceramide(1-) [Term] id: CHEBI:139066 name: mannosylinositol-1-phosphophytoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64991 ! mannosylinositol phosphophytoceramide(1-) [Term] id: CHEBI:139068 name: inositol phosphomannosylinositol-1-phosphophytoceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:64992 ! inositol phosphomannosylinositol phosphophytoceramide(2-) [Term] id: CHEBI:139069 name: 4-hydroxytryptamine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:139070 name: norbaeocystin(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139071 name: baeocystin(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139072 name: psilocybin(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:35941 ! serotonergic agonist relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:139073 name: N(5)-phospho-L-glutamine(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:139083 name: (E)-hex-4-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139085 name: (9R,13R)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:35744 ! carbocyclic fatty acid is_a: CHEBI:36140 ! cyclopentanones is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:139089 name: N(6)-methyl-2'-deoxyadenosine 5'-monophosphate residue is_a: CHEBI:65305 ! purine deoxyribonucleotide residue [Term] id: CHEBI:139090 name: inositol phosphomannosylinositol-1-phospho-N-acylphytosphingosine(2-) subset: chebi_ph7_3 is_a: CHEBI:139068 ! inositol phosphomannosylinositol-1-phosphophytoceramide(2-) [Term] id: CHEBI:139094 name: 2'-deoxyribose 5'-monophosphate residue is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:139095 name: 2'-deoxyribose 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:139098 name: alpha-D-galactosyl-(1->4)-beta-D-galactosyl group subset: chebi_ph7_3 is_a: CHEBI:22778 ! beta-D-galactosyl groups relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:139104 name: (R,R)-3-(3-hydroxydecanoyloxy)decanoate subset: chebi_ph7_3 is_a: CHEBI:62239 ! 3-hydroxydecanoyl-3-hydroxydecanoate [Term] id: CHEBI:139105 name: (9S,13S)-1a,1b-dinor-10,11-dihydro-12-oxo-15-phytoenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61903 ! oxo-fatty acyl-CoA [Term] id: CHEBI:139107 name: (9S,13S)-1a,1b-dinor-12-oxo-10,15-phytodienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61903 ! oxo-fatty acyl-CoA [Term] id: CHEBI:139108 name: hexadecanoyl phosphate is_a: CHEBI:16826 ! acyl monophosphate [Term] id: CHEBI:139110 name: (R,R)-3-(3-hydroxydecanoyloxy)decanoic acid is_a: CHEBI:62406 ! 3-hydroxydecanoyl-3-hydroxydecanoic acid [Term] id: CHEBI:139114 name: carotenoid psi-end derivative subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:139115 name: carotenoid epsilon-end derivative subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:139120 name: carotenoid beta-end derivative subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:139121 name: (3E,5Z)-dodecadienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA is_a: CHEBI:85559 ! (3E,5Z)-dienoyl-CoA [Term] id: CHEBI:139122 name: (3R)-3-hydroxy-2,3-dihydrotabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:139124 name: (3R)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:139126 name: C-terminal S-carbamoyl-L-cysteinate residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:139127 name: C-terminal S-cyano-L-cysteinate residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:139129 name: carotenoid phi-end group subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:139130 name: carotenoid chi-end group subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:139145 name: 4-O-(\{poly[2-N-acetyl-alpha-D-glucosaminyl-1-D-ribitylphosphonato]}-di\{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139146 name: 4-O-(\{poly[2-N-acetyl-beta-D-glucosaminyl-1-D-ribitylphosphonato]}-di\{[2R]-1-glycerylphosphonato})-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139147 name: mannose-1D-myo-inositol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:67140 ! phosphate monoester dianion [Term] id: CHEBI:139148 name: mannose-(1D-myo-inositol 1-phosphate)2(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139149 name: 4-O-[poly(2-beta-D-glucosyl-1-D-ribitylphosphonato)-1-D-ribitylphosphonato-(2R)-1-glycerylphosphonato]-N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl ditrans,octacis-undecaprenyl diphosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139150 name: (S,S)-bis-(3-oleoylglycero)-1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:77717 ! 2,2'-lysobisphosphatidate [Term] id: CHEBI:139151 name: ADP-5-ethyl-4-methylthiazole-2-carboxylate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139152 name: (S,S)-3-oleoylglycero-1-phospho-1'-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:197425 ! a 3-acyl-sn-glycero-1-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:78211 ! 1-acylglycero-3-phospho-1'-glycerol(1-) [Term] id: CHEBI:139154 name: AZD1979 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35624 ! azaspiro compound is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:38784 ! oxetanes is_a: CHEBI:46685 ! oxadiazole is_a: CHEBI:46959 ! N-acylazetidine relationship: has_role CHEBI:139155 ! melanin-concentrating hormone receptor antagonist [Term] id: CHEBI:139155 name: melanin-concentrating hormone receptor antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:139156 name: (S,S)-bis-(2-oleoylglycero)-1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:77720 ! 1,1'-lysobisphosphatidate [Term] id: CHEBI:139157 name: (S,S)-2-oleoylglycero-1-phospho-1'-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:139158 name: [(1->2)-alpha-L-rhamnosyl-(1->4)-alpha-D-galacturonosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139159 name: alpha-D-galacturonosyl-[(1->2)-alpha-L-rhamnosyl-(1->4)-alpha-D-galacturonosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139160 name: 1-(4-methoxyphenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]methanamine is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38784 ! oxetanes is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:139161 name: 1-(4-methoxyphenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]methanamine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:139162 name: oleuropein aglycone subset: chebi_ph7_3 is_a: CHEBI:139166 ! secoiridoid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26407 ! pyrans is_a: CHEBI:33566 ! catechols is_a: CHEBI:38131 ! lactol is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:137514 ! TRPA1 channel agonist relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68481 ! mTOR inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:139163 name: 2-\{[(4-methoxybenzyl)(methyl)amino]methyl}-2-methylpropane-1,3-diol is_a: CHEBI:23824 ! diol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:139164 name: 2-\{[(4-methoxybenzyl)(methyl)amino]methyl}-2-methylpropane-1,3-diol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:139166 name: secoiridoid is_a: CHEBI:50563 ! iridoid monoterpenoid [Term] id: CHEBI:139171 name: N(2)-[(3R)-3-(2-hydroxyacyloxy)acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:139179 name: 4,4'-diapolycopen-4-oic acid is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139181 name: 1-O-(all-trans-retinoyl)-beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:139186 ! retinoid glucosiduronic acid anion [Term] id: CHEBI:139182 name: 4-(beta-D-glucopyranuronosyloxy)retinoate(2-) subset: chebi_ph7_3 is_a: CHEBI:139186 ! retinoid glucosiduronic acid anion [Term] id: CHEBI:139183 name: 5,6-epoxyretinoate subset: chebi_ph7_3 is_a: CHEBI:139589 ! retinoid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:139184 name: 1-O-(5,6-epoxyretinoyl)-beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:139186 ! retinoid glucosiduronic acid anion [Term] id: CHEBI:139185 name: 1-O-(4-oxoretinoyl)-beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:139186 ! retinoid glucosiduronic acid anion [Term] id: CHEBI:139186 name: retinoid glucosiduronic acid anion is_a: CHEBI:139589 ! retinoid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:139187 name: 2-hydroxy fatty acid anion 14:0 subset: chebi_ph7_3 is_a: CHEBI:139188 ! hydroxy fatty acid anion 14:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139188 name: hydroxy fatty acid anion 14:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:139189 name: 2-hydroxy fatty acid anion 16:0 subset: chebi_ph7_3 is_a: CHEBI:139190 ! hydroxy fatty acid anion 16:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139190 name: hydroxy fatty acid anion 16:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:139191 name: 2-hydroxy fatty acid anion 18:0 subset: chebi_ph7_3 is_a: CHEBI:139192 ! hydroxy fatty acid anion 18:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139192 name: hydroxy fatty acid anion 18:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:139193 name: 2-hydroxy fatty acid anion 20:0 subset: chebi_ph7_3 is_a: CHEBI:139194 ! hydroxy fatty acid anion 20:0 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139194 name: hydroxy fatty acid anion 20:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:139195 name: 2-hydroxy fatty acid anion 22:0 subset: chebi_ph7_3 is_a: CHEBI:139196 ! hydroxy fatty acid anion 22:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139196 name: hydroxy fatty acid anion 22:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:139197 name: 2-hydroxy fatty acid anion 24:0 subset: chebi_ph7_3 is_a: CHEBI:139198 ! hydroxy fatty acid anion 24:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139198 name: hydroxy fatty acid anion 24:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:139199 name: 2-hydroxy fatty acid anion 26:0 subset: chebi_ph7_3 is_a: CHEBI:139200 ! hydroxy fatty acid anion 26:0 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:139200 name: hydroxy fatty acid anion 26:0 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion [Term] id: CHEBI:139215 name: cochalic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:139217 name: 4-hydroxytryptamine is_a: CHEBI:27162 ! tryptamines is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:139218 name: secondary nitroalkane subset: chebi_ph7_3 is_a: CHEBI:7587 ! nitroalkane [Term] id: CHEBI:139228 name: (R,R)-bis(2-oleoylglycero)-3-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:83236 ! 2-acylglycerophospho-(2'-acylglycerol)(1-) [Term] id: CHEBI:139230 name: (R,R)-2-oleoylglycero-1-phospho-1'-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:139231 name: 5-methyldeoxycytidine 5'-monophosphate residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:139235 name: (3E,5Z)-dodecadienoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:139236 name: (R)-3-hydroxypentanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:139237 name: bacteriochlorophyllide f(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:139239 name: (R)-3-hydroxypentanoic acid is_a: CHEBI:139272 ! 3-hydroxypentanoic acid [Term] id: CHEBI:139240 name: 7(1)-hydroxybacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:139242 name: 7(1),7(1)-dihydroxybacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:139248 name: [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:50523 ! butenolide is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139252 name: [8)-alpha-Neu5Ac-(2->]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139258 name: all-trans-18-hydroxyretinoate subset: chebi_ph7_3 is_a: CHEBI:139589 ! retinoid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:139267 name: [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:51849 ! beta-ketoester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139268 name: (S)-3-hydroxypentanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:139269 name: 6beta-hydroxycortisone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:50406 ! probe relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:139270 name: (S)-3-hydroxypentanoic acid is_a: CHEBI:139272 ! 3-hydroxypentanoic acid [Term] id: CHEBI:139271 name: 6beta-hydroxycortisol subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:50406 ! probe relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:139272 name: 3-hydroxypentanoic acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid is_a: CHEBI:73693 ! ketone body [Term] id: CHEBI:139273 name: 4-O-methylxanthohumol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:139274 name: calcitriol 25-O-(beta-D-glucuronate) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167104 ! seco-cholestane conjugate [Term] id: CHEBI:139277 name: calcidiol 25-O-(beta-D-glucuronate) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167104 ! seco-cholestane conjugate [Term] id: CHEBI:139278 name: calcidiol 3-O-(beta-D-glucuronate) subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167104 ! seco-cholestane conjugate [Term] id: CHEBI:139285 name: [(2->8)-N,O(7)-diacetyl-alpha-D-neuraminosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139286 name: [(2->8)-N,O(9)-diacetyl-alpha-D-neuraminosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139287 name: [(2->6)-alpha-D-glucosyl-(1->4)-N-acetyl-alpha-D-neuraminosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139288 name: [(2->6)-alpha-D-glucosyl-(1->4)-N,O(7)-diacetyl-alpha-D-neuraminosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139289 name: [(2->6)-alpha-D-glucosyl-(1->4)-N,O(9)-diacetyl-alpha-D-neuraminosyl]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139291 name: chlorophyll(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:139292 name: chlorophyllide(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:139296 name: D-alanyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:139300 name: (+)-jasmonic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:36140 ! cyclopentanones relationship: has_role CHEBI:24937 ! jasmonates [Term] id: CHEBI:139301 name: N-[(3R)-12-hydroxyjasmonyl]-L-isoleucine is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:139302 name: N-[(3R)-jasmonyl]-L-isoleucine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:139303 name: 2-hydroxybutanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:139304 name: 2-hydroxyhexanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139319 name: S-disulfanyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139321 name: S-(sulfosulfanyl)-L-cysteine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:139323 name: coelenterazine 2-hydroperoxide subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35924 ! peroxol is_a: CHEBI:37847 ! imidazopyrazine relationship: has_role CHEBI:25747 ! oxidized luciferins relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:139324 name: coelenterazine dioxetanone subset: chebi_ph7_3 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38314 ! pyrazines is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:139332 name: 5-chloro-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:139335 name: 6-chloro-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:139336 name: 6,7-dichloro-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:139337 name: (4Z,8Z)-4,8-dimethyl-12-oxotrideca-4,8-dienal subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:59768 ! aliphatic aldehyde is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:139338 name: EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:139339 name: EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitor is_a: CHEBI:139338 ! EC 1.14.17.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen and with reduced ascorbate as one donor, and incorporation of one atom of oxygen) inhibitor [Term] id: CHEBI:139340 name: 1,3-dihydroimidazole-2-thiones subset: chebi_ph7_3 is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:51276 ! thioureas [Term] id: CHEBI:139346 name: all-trans-4-hydroxyretinal subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26537 ! retinoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:139362 name: 2-hydroxy-3-methylundecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139363 name: 2-hydroxy-3-methylnonanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139371 name: aryl sulfate oxoanion subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:139372 name: 3-methylnonanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139375 name: (R)-2-hydroxyhexadecanoyl-CoA is_a: CHEBI:74137 ! 2-hydroxyhexadecanoyl-CoA [Term] id: CHEBI:139376 name: 2-hydroxy-3-methyldodecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139392 name: 3-methyldodecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:139394 name: alpha-D-galactosyl ditrans,octacis-undecaprenyl diphosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:139396 name: CDP-4-dehydro-6-deoxy-alpha-D-glucose is_a: CHEBI:17494 ! CDP-4-dehydro-6-deoxy-D-glucose is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:139397 name: N-hexadecanoyl-O-(1-octadecanoyl-2-oleoyl-sn-glycero-3-phospho)-L-serine is_a: CHEBI:139398 ! N-acyl-O-(3-sn-phosphatidyl)-L-serine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:139398 name: N-acyl-O-(3-sn-phosphatidyl)-L-serine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:52565 ! acylglycerophosphoserine is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:139399 name: N-hexadecanoyl-O-(1-octadecanoyl-sn-glycero-3-phospho)-L-serine is_a: CHEBI:139400 ! N-acyllysophosphatidyl-L-serine [Term] id: CHEBI:139400 name: N-acyllysophosphatidyl-L-serine is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:52565 ! acylglycerophosphoserine is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:139401 name: N-hexadecanoyl-1-[(1Z)-octadecenoyl]-2-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:140593 ! N-acyl-1-[(1Z)-alkenyl]-2-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:13941 name: carbamate subset: chebi_ph7_3 is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:139413 name: 1-oleoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:139419 name: beta-D-fructofuranose 1-phosphate is_a: CHEBI:37515 ! D-fructofuranose 1-phosphate [Term] id: CHEBI:139446 name: Man-1-6-Ins-1-P-Cer(d18:0) is_a: CHEBI:25168 ! mannosylinositol phosphorylceramide [Term] id: CHEBI:139471 name: (4S)-2,3-dehydroleucocyanidin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33823 ! enol is_a: CHEBI:39436 ! chromenol [Term] id: CHEBI:139472 name: (4S)-2,3-dehydroleucopelargonidin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33823 ! enol is_a: CHEBI:39436 ! chromenol [Term] id: CHEBI:139477 name: mogroside is_a: CHEBI:61778 ! triterpenoid saponin [Term] id: CHEBI:139478 name: nerylneryl diphosphate is_a: CHEBI:15831 ! geranylgeranyl diphosphate [Term] id: CHEBI:139479 name: norbaeocystin is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:48274 ! tryptamine alkaloid is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:139480 name: (+)-O-methylkolavelool subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:25698 ! ether relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139481 name: 5-chloro-L-tryptophan is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:139492 name: sensitiser is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:139493 name: N(4)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc]-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:192714 ! an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139497 name: N(4)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139498 name: N(4)-(alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139499 name: N(4)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:1395 name: 3,5-dibromo-4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:37147 ! dibromobenzene relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:139500 name: N(4)-(alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc)-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139504 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139505 name: baeocystin is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:48274 ! tryptamine alkaloid is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:139506 name: N(5)-phospho-L-glutamine is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:37773 ! organic phosphoramidate [Term] id: CHEBI:139507 name: N(4)-\{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139508 name: beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:139509 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:139510 name: N(4)-\{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139511 name: reduced coenzyme F420-(gamma-Glu)n polyanion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:139513 name: N(4)-\{beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:139514 name: nonaflavuxanthin subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:87168 ! C45 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139515 name: flavuxanthin subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:23824 ! diol is_a: CHEBI:87165 ! C50 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:139518 name: (5R)-5,6-dihydro-5-(thymidin-7-yl)thymidine dimer(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:139519 name: thymidine dimer(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:139520 name: phenolic donor subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:139521 name: phenolic radical donor subset: chebi_ph7_3 is_a: CHEBI:36872 ! organic radical relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:139529 name: inositol phosphomannosylinositol-1-phospho-N-acylphytosphingosine is_a: CHEBI:65006 ! inositol phosphomannosylinositol phosphophytoceramide [Term] id: CHEBI:139539 name: (S,S)-bis-(3-oleoylglycero)-1-phosphate is_a: CHEBI:60818 ! 2,2'-lysobisphosphatidic acid [Term] id: CHEBI:139540 name: (S,S)-3-oleoylglycero-1-phospho-1'-glycerol is_a: CHEBI:24360 ! glycerophosphoglycerols [Term] id: CHEBI:139541 name: (S,S)-bis(2-oleoylglycero)-1-phosphate is_a: CHEBI:60817 ! 1,1'-lysobisphosphatidic acid [Term] id: CHEBI:139543 name: (S,S)-2-oleoylglycero-1-phospho-1'-glycerol is_a: CHEBI:24360 ! glycerophosphoglycerols [Term] id: CHEBI:139553 name: 7(1)-hydroxybacteriochlorophyllide d is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:139555 name: 7(1),7(1)-dihydroxybacteriochlorophyllide d is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:139556 name: EC 4.1.1.17 (ornithine decarboxylase) inhibitor is_a: CHEBI:76906 ! EC 4.1.1.* (carboxy-lyase) inhibitor [Term] id: CHEBI:139558 name: 1-O-(5,6-epoxyretinoyl)-beta-D-glucuronic acid is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:139559 name: (9Z,12R)-12-hydroxyoctadec-9-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:13956 name: ceramide 1-phosphate is_a: CHEBI:17761 ! ceramide is_a: CHEBI:35786 ! phosphosphingolipid [Term] id: CHEBI:139561 name: archaeal dolichyl alpha-D-glucosyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139562 name: archaeal dolichyl beta-D-glucuronosyl-(1->4)-alpha-D-glucosyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:139563 name: octadecatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:139565 name: octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:139567 name: octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:139569 name: 8-amino-8-demethylriboflavin 5'-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139570 name: 8-formyl-8-demethylriboflavin 5'-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:139571 name: 8-carboxy-8-demethylriboflavin 5'-phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:91007 ! aromatic carboxylate [Term] id: CHEBI:139572 name: hexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:139574 name: octadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:139575 name: monounsaturated fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:139576 name: octadecatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:139578 name: octadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:139580 name: O(3)-[N-acetyl-beta-D-glucosaminyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminyl]-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139581 name: O(3)-[N-acetyl-beta-D-glucosaminyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminyl]-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139583 name: (R,R)-bis(2-oleoylglycero)-3-phosphate is_a: CHEBI:60815 ! lysobisphosphatidic acid [Term] id: CHEBI:139585 name: (R,R)-2-oleoylglycero-1-phospho-1'-glycerol is_a: CHEBI:24360 ! glycerophosphoglycerols [Term] id: CHEBI:139588 name: alpha-hydroxy ketone is_a: CHEBI:30879 ! alcohol is_a: CHEBI:52396 ! alpha-oxyketone [Term] id: CHEBI:139589 name: retinoid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:139590 name: primary alpha-hydroxy ketone subset: chebi_ph7_3 is_a: CHEBI:139588 ! alpha-hydroxy ketone is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:139592 name: tertiary alpha-hydroxy ketone subset: chebi_ph7_3 is_a: CHEBI:139588 ! alpha-hydroxy ketone is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:139593 name: 4-O-methylxanthohumol is_a: CHEBI:23086 ! chalcones is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:139596 name: N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:139597 name: O(3)-[N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:139598 name: O(3)-[N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl]-L-threonine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:139600 name: calcitriol 25-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:139604 name: beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:139605 name: O(3)-\{beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminyl}-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139607 name: O(3)-\{beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminyl}-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139610 name: calcidiol 25-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:139611 name: O(3)-\{beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->3)-[beta-D-GlcNAc-(1->6)]-alpha-D-GalNAc}-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139612 name: O(3)-\{N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosaminyl}-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:139613 name: calcidiol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:13997 name: citramalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:140077 name: 6-chloro-L-tryptophan is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:140080 name: O(3)-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl]-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140082 name: 2-octanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:140083 name: O(3)-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl]-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140084 name: all-trans-retinyl octanoate subset: chebi_ph7_3 is_a: CHEBI:63410 ! all-trans-retinyl ester is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:140085 name: O(3)-\{N-acetyl-beta-D-glucosaminyl-(1->2)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl}-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140086 name: 6,7-dichloro-L-tryptophan is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:140087 name: O(3)-\{N-acetyl-beta-D-glucosaminyl-(1->2)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-alpha-D-mannosyl}-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140088 name: 2-dodecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:140089 name: all-trans-retinyl dodecanoate subset: chebi_ph7_3 is_a: CHEBI:63410 ! all-trans-retinyl ester is_a: CHEBI:87659 ! dodecanoate ester relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:140135 name: 8-amino-8-demethylriboflavin 5'-phosphate is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:26554 ! ribitol phosphate [Term] id: CHEBI:140153 name: (9Z,12R)-12-hydroxyoctadec-9-enoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:140156 name: 8-formyl-8-demethylriboflavin 5'-phosphate is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:33855 ! arenecarbaldehyde [Term] id: CHEBI:140157 name: 8-carboxy-8-demethylriboflavin 5'-phosphate is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:140159 name: D-hexose phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140161 name: phosphatidylcholine (20:4/16:0) subset: chebi_ph7_3 is_a: CHEBI:64520 ! phosphatidylcholine 36:4 [Term] id: CHEBI:140165 name: Brassica napus metabolite is_a: CHEBI:76924 ! plant metabolite [Term] id: CHEBI:140168 name: N(4)-\{alpha-Neu5Ac-(2->6)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:140169 name: N(4)-\{beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:140170 name: N(4)-\{beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:140179 name: 3'-L-prolyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140181 name: (3R,4R)-4,2'-dihydroxyisoflavans subset: chebi_ph7_3 is_a: CHEBI:76250 ! hydroxyisoflavans [Term] id: CHEBI:140182 name: hydroxyalbendazole subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:35683 ! aryl sulfide relationship: has_role CHEBI:49103 ! drug metabolite [Term] id: CHEBI:140183 name: (3R)-2'-hydroxyisoflavanones subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone [Term] id: CHEBI:140184 name: hydroxyfenbendazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:33853 ! phenols is_a: CHEBI:35683 ! aryl sulfide relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:140188 name: 2alpha-hydroxy-ent-isokaurene subset: chebi_ph7_3 is_a: CHEBI:36760 ! ent-kaurane diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:140189 name: omega-hydroxy-beta-dihydromenaquinone-9 subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:25185 ! menaquinones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140195 name: 21-phosphorifampicin(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140203 name: 3-bromo-4-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate [Term] id: CHEBI:140211 name: 3-bromo-4,5-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:140214 name: 3,5-dibromocatechol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:37147 ! dibromobenzene relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:140219 name: O-[S-(4,5-dichloropyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:140221 name: O-[S-(5-chloropyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:140232 name: sordaricin(1-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:140233 name: 4'-O-demethylsordarin(1-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:140241 name: 3-bromo-4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:37149 ! bromobenzenes relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:140242 name: 3-bromo-4,5-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:37149 ! bromobenzenes relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:140259 name: sordaricin is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:140260 name: (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate [Term] id: CHEBI:14027 name: corydaline subset: chebi_ph7_3 is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:24922 ! isoquinolines [Term] id: CHEBI:140275 name: 2alpha,3alpha-dihydroxy-ent-isokaurene subset: chebi_ph7_3 is_a: CHEBI:36760 ! ent-kaurane diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:140276 name: 21-phosphorifampicin is_a: CHEBI:26580 ! rifamycins is_a: CHEBI:38532 ! hydrazone is_a: CHEBI:46847 ! N-iminopiperazine is_a: CHEBI:46920 ! N-methylpiperazine is_a: CHEBI:59779 ! cyclic ketal is_a: CHEBI:72588 ! semisynthetic derivative is_a: CHEBI:7794 ! phosphate monoester [Term] id: CHEBI:140277 name: 5-hydroxyanthocyanidin subset: chebi_ph7_3 is_a: CHEBI:16366 ! anthocyanidin cation [Term] id: CHEBI:140278 name: 5-hydroxyanthocyanin O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:140284 name: deoxyribonucleotide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:140286 name: deoxyribonucleoside 5'-methylphosphate residue subset: chebi_ph7_3 is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:140294 name: 5'-triphosphoadenylyl-(2'->5')-adenosine(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140297 name: 4'-O-demethylsordarin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24400 ! glycoside is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:52557 ! tetracyclic diterpenoid is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:14030 name: crepenynate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion [Term] id: CHEBI:140301 name: 7-hydroxyisoflavones 7-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38757 ! isoflavones is_a: CHEBI:74630 ! glycosyloxyisoflavone [Term] id: CHEBI:140302 name: beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:140303 name: beta-D-galactosyl-(1->4)-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:140304 name: beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:140305 name: genistein 7-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:140306 name: 2'-hydroxygenistein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:140308 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactoside(1-) subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates [Term] id: CHEBI:140309 name: alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactoside(2-) subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates [Term] id: CHEBI:140310 name: phenyl acetates subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:140311 name: FMNH(.)(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140312 name: [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-N-(beta-D-Asp)-L-Lys-D-Ala-D-Ala)]n polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:140314 name: 5'-triphosphoadenylyl-(2'->5')-adenosine is_a: CHEBI:75800 ! (2'->5')-dinucleotide relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140317 name: phenyl sulfate oxoanion subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion [Term] id: CHEBI:140324 name: primary carboxamide subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:140325 name: secondary carboxamide subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:140326 name: tertiary carboxamide subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:140327 name: alpha-L-fucosyl-(1->2)-beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:140328 name: alpha-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:140329 name: 13-deoxycarminomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:140330 name: (13R)-13-dihydrocarminomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:140331 name: 4'-hydroxyflavanones subset: chebi_ph7_3 is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:140332 name: 4'-methoxyflavanones subset: chebi_ph7_3 is_a: CHEBI:25240 ! methoxyflavanone [Term] id: CHEBI:140335 name: glucuronoxylan D-glucuronate polyanion subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:140336 name: glucuronoxylan 4-O-methyl-D-glucuronate polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:140345 name: hydroxy polyunsaturated fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:140347 name: substituted beta-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:140351 name: 3'-methoxyflavanones subset: chebi_ph7_3 is_a: CHEBI:25240 ! methoxyflavanone [Term] id: CHEBI:140353 name: phosphatidic acid 40:6 is_a: CHEBI:16337 ! phosphatidic acid [Term] id: CHEBI:140354 name: phosphatidic acid 38:4 is_a: CHEBI:16337 ! phosphatidic acid [Term] id: CHEBI:140356 name: 7-methoxyisoflavones subset: chebi_ph7_3 is_a: CHEBI:38756 ! methoxyisoflavone [Term] id: CHEBI:140357 name: N(4)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:140358 name: monosaccharide 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:140359 name: UDP-monosaccharide(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:140369 name: N(4)-[6-(N-acetyl-alpha-D-glucosaminyl-1-phospho)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue(1-) subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:140371 name: N(4)-[6-phospho-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-glycan]-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:140372 name: 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate(13-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:140374 name: 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate(13-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:140377 name: (2S)-flavan-4-one subset: chebi_ph7_3 is_a: CHEBI:28863 ! flavanones [Term] id: CHEBI:140379 name: an aldopyranose subset: chebi_ph7_3 is_a: CHEBI:15693 ! aldose is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140380 name: an aldono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:22302 ! aldonolactone is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140383 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:140384 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:140385 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:140388 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoic acid is_a: CHEBI:140392 ! (3R)-3-hydroxybutanoic acid oligomer is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:140390 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoic acid is_a: CHEBI:140392 ! (3R)-3-hydroxybutanoic acid oligomer relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:140391 name: (3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-\{[(3R)-3-hydroxybutanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoyl]oxy}butanoic acid is_a: CHEBI:140392 ! (3R)-3-hydroxybutanoic acid oligomer [Term] id: CHEBI:140392 name: (3R)-3-hydroxybutanoic acid oligomer is_a: CHEBI:132554 ! oligomer is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:140395 name: poly(nucleoside 5'-monophosphate) polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:140399 name: specialised pro-resolving mediator is_a: CHEBI:24432 ! biological role is_a: CHEBI:62488 ! signalling molecule is_a: CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:140403 name: N-acyl-1-[(1Z)-alkenyl]-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:140426 name: 2,4,6-trichlorophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:140432 name: [(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64560 ! lysophosphatidylcholine 16:1 [Term] id: CHEBI:140433 name: GDP-6-deoxy-alpha-D-altrose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:140434 name: 3-[(Z)-2-isocyanovinyl]indole subset: chebi_ph7_3 is_a: CHEBI:144370 ! 3-(2-isocyanovinyl)indole relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140439 name: 3-geranyl-3-[(Z)-2-isocyanovinyl]-3H-indole subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:35353 ! isocyanide is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:140440 name: hapalindole H subset: chebi_ph7_3 is_a: CHEBI:141617 ! hapalindole is_a: CHEBI:35353 ! isocyanide is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140441 name: 12-epi-hapalindole U subset: chebi_ph7_3 is_a: CHEBI:141617 ! hapalindole is_a: CHEBI:35353 ! isocyanide is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140442 name: 12-epi-fischerindole U subset: chebi_ph7_3 is_a: CHEBI:141619 ! fischerindole alkaloid is_a: CHEBI:35353 ! isocyanide is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:140444 name: linoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64549 ! lysophosphatidylcholine 18:2 [Term] id: CHEBI:140445 name: alpha-linolenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64565 ! lysophosphatidylcholine 18:3 [Term] id: CHEBI:140446 name: ricinoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:84465 ! acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:140451 name: N-acyl-1-[(1Z)-alkenyl]-2-acyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:140452 name: 1-[(1Z)-octadecenyl]-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77284 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:140454 name: O-[S-(5-bromopyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:140455 name: O-[S-(4,5-dibromopyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:140456 name: O-[S-(3,4,5-tribromopyrrole-2-carbonyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:140466 name: hederagenin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:140467 name: gypsogenin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:140468 name: gypsogenate(2-) subset: chebi_ph7_3 is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:140471 name: triricinolein subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:140489 name: tropomyosin-related kinase B receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:140494 name: O(3)-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-2-O-phospho-xylosyl)-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140495 name: O(3)-(beta-D-glucuronosyl-(1->3)-beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-2-O-phospho-xylosyl)-L-serine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:140497 name: 12,18-didecarboxysiroheme(6-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:140498 name: dihydro-ferroheme d1(4-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:140509 name: 6-chloro-D-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:140515 name: 6-chloro-D-tryptophan is_a: CHEBI:140516 ! 6-chlorotryptophan is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:47997 ! D-tryptophan derivative [Term] id: CHEBI:140516 name: 6-chlorotryptophan is_a: CHEBI:27164 ! tryptophan derivative is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:140521 name: 13-methyltetradecenal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde [Term] id: CHEBI:140522 name: [(1->4)-alpha-D-galacturonosyl methyl ester](n) subset: chebi_ph7_3 is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:140523 name: [(1->4)-alpha-D-galacturonosyl](n) subset: chebi_ph7_3 is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:140525 name: sn-1,2-diricinolein subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:140526 name: 1,2-dihexanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:177077 ! 1,2-dihexanoylglycerol is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:140527 name: 1,2-dihexanoyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140528 name: 6-methylthioguanine subset: chebi_ph7_3 is_a: CHEBI:20702 ! 2-aminopurines is_a: CHEBI:35666 ! thiopurine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:140531 name: GDP-6-deoxy-alpha-D-altrose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:140532 name: N-arachidonoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:140533 name: 3-acetamido-4-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:140534 name: 3-acetylamino-4-hydroxybenzaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:13790 ! N-acetylarylamine [Term] id: CHEBI:140535 name: TRPV1 agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:140537 name: diethylphosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:138518 ! dialkyl phosphate(1-) [Term] id: CHEBI:140559 name: N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactose derivative subset: chebi_ph7_3 is_a: CHEBI:63360 ! glycosylgalactose derivative relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:140561 name: (1->4)-3,6-bis(phospho)-alpha-D-glucan polyanion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:140564 name: delta-cadinene subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:22976 ! cadinene [Term] id: CHEBI:140572 name: heparan sulfate alpha-D-N-sulfoglucosamine polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:140573 name: alpha-D-glucosyl-L-tyrosyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140574 name: (1,4-alpha-D-glucosyl)(n)-L-tyrosyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140575 name: alpha-D-xylose-(1->3)-beta-D-glucose-L-seryl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140576 name: beta-D-glucose-L-seryl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140577 name: beta-D-glucosyl-L-threonyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140578 name: alpha-D-xylose-(1->3)-beta-D-glucose-L-threonyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140593 name: N-acyl-1-[(1Z)-alkenyl]-2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:140594 name: ethanediol derivative subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol [Term] id: CHEBI:140595 name: 1-[(1Z)-octadecenyl]-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:52567 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphate [Term] id: CHEBI:140596 name: monosubstituted aliphatic (S)-cyanohydrin subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin [Term] id: CHEBI:140597 name: disubstituted aliphatic (S)-cyanohydrin subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin [Term] id: CHEBI:140599 name: alpha-D-xylose-(1->3)-alpha-D-xylose-(1->3)-beta-D-glucose-L-seryl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140600 name: alpha-D-xylose-(1->3)-alpha-D-xylose-(1->3)-beta-D-glucose-L-threonyl residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140601 name: fatty acid 4:0 is_a: CHEBI:26666 ! short-chain fatty acid [Term] id: CHEBI:140602 name: Arabidopsis thaliana metabolite is_a: CHEBI:76924 ! plant metabolite [Term] id: CHEBI:140603 name: 3-acetamido-4-hydroxybenzoic acid is_a: CHEBI:13790 ! N-acetylarylamine is_a: CHEBI:25389 ! monohydroxybenzoic acid [Term] id: CHEBI:140604 name: heparan sulfate alpha-D-glucosaminide 6-sulfate polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:140605 name: tetrahydrosulfopterin subset: chebi_ph7_3 is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:140606 name: 5,10-methylenetetrahydrosulfopterin subset: chebi_ph7_3 is_a: CHEBI:26375 ! pterins is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140607 name: S-(ADP-D-ribosyl)-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:140610 name: 4'-hydroxyechinenone subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:51689 ! enone [Term] id: CHEBI:140613 name: L,L-homocystine zwitterion subset: chebi_ph7_3 is_a: CHEBI:58163 ! homocystine zwitterion [Term] id: CHEBI:140614 name: alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Ceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140615 name: alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:140614 ! alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Ceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140616 name: N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Ceramide subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140617 name: N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140619 name: alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:36640 ! glycoheptaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140620 name: alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:140619 ! alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140623 name: Monosialyl-Gb5(1-) subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140624 name: disialosyl Gb5(2-) subset: chebi_ph7_3 is_a: CHEBI:36640 ! glycoheptaosylceramide is_a: CHEBI:61360 ! globoside relationship: has_role CHEBI:144829 ! tumour antigen [Term] id: CHEBI:140625 name: 5-chlorocarbonyl-4-hydroxy-penta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36687 ! acyl chloride [Term] id: CHEBI:140626 name: RNA(n)-3'-adenine ribonucleotide polyanion subset: chebi_ph7_3 is_a: CHEBI:33697 ! ribonucleic acid is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:140627 name: RNA(n)-3'-uridine ribonucleotide polyanion subset: chebi_ph7_3 is_a: CHEBI:33697 ! ribonucleic acid is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:140629 name: dialurate subset: chebi_ph7_3 is_a: CHEBI:22691 ! barbiturate anion [Term] id: CHEBI:140632 name: 5-methylaminomethyl-S-(2E)-geranyl-thiouridine 5'-monophosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:140633 name: 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate subset: chebi_ph7_3 is_a: CHEBI:38181 ! pyridinemonocarboxylate [Term] id: CHEBI:140634 name: 3-oxochol-4,6-dien-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138842 ! 3alpha-hydroxy bile acid CoA thioester(4-) [Term] id: CHEBI:140635 name: 12alpha-hydroxy-3-oxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:140636 name: 7alpha-hydroxy-3-oxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:140637 name: 7beta-hydroxy-3-oxochol-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:140638 name: 7beta-hydroxy-3-oxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138843 ! 3-oxo bile acid CoA thioester(4-) [Term] id: CHEBI:140639 name: dihydro-4-coumaroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:140640 name: dihydroferuloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57276 ! feruloyl-CoA(4-) [Term] id: CHEBI:140641 name: rhizobitoxine(1+) subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:140642 name: dihydrorhizobitoxine subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:140646 name: poly(2,5-ethylene furandicarboxylate)(1-) subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:140647 name: (2S)-3-(4-hydroxyphenyl)-2-isocyanopropanoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140648 name: (2E)-3-(4-hydroxyphenyl)-2-isocyanoprop-2-enoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140650 name: 4-[(E)-2-isocyanoethenyl]phenol subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140652 name: (2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140654 name: 3-[(E)-2-isocyanovinyl]indole subset: chebi_ph7_3 is_a: CHEBI:144370 ! 3-(2-isocyanovinyl)indole [Term] id: CHEBI:140655 name: 16alpha-hydroxy-beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:140656 name: N-terminal S-1,2-diacyl-sn-glyceryl-L-cysteine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:29950 ! L-cysteine residue [Term] id: CHEBI:140657 name: N-acyl-S-1,2-diacyl-sn-glyceryl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140658 name: S-1,2-diacyl-sn-glyceryl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:29950 ! L-cysteine residue [Term] id: CHEBI:140660 name: a 2-acyl-sn-glycero-3-phospholipid subset: chebi_ph7_3 is_a: CHEBI:136913 ! monoacyl-sn-glycero-3-phospholipid [Term] id: CHEBI:140662 name: 2,4-diacetylphloroglucinol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:140663 name: N(2)-[(3R)-3-(acyloxy)acyl]-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:140664 name: S-(2-sulfodisulfanyl)-L-cysteine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:140675 name: 3-hydroxyacyl derivative of bacterial toxin subset: chebi_ph7_3 is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:140676 name: 4',4'-dihydroxyechinenone subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone is_a: CHEBI:51689 ! enone [Term] id: CHEBI:140677 name: 4-hydroxy-all-trans-beta-carotene subset: chebi_ph7_3 is_a: CHEBI:35163 ! cyclic carotene [Term] id: CHEBI:140678 name: 4,4-dihydroxy-all-trans-beta-carotene subset: chebi_ph7_3 is_a: CHEBI:35163 ! cyclic carotene [Term] id: CHEBI:140691 name: beta-D-Gal-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140714 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer subset: chebi_ph7_3 is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140725 name: 4-Imidazolone-5-propanoate(1-) is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:140741 name: hypotaurine(1-) is_a: CHEBI:37785 ! organosulfinate oxoanion [Term] id: CHEBI:140743 name: alpha-D-Gal-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:140750 name: D-5-phenylhydantoin subset: chebi_ph7_3 is_a: CHEBI:86339 ! D-5-monosubstituted hydantoin [Term] id: CHEBI:140758 name: N-carbamoyl-D-phenylglycine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:140764 name: beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminyl-(2->6)]-N-acetyl-alpha-D-galactosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:140773 name: lysophosphatidylcholine P-16:0 subset: chebi_ph7_3 is_a: CHEBI:17832 ! 1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine [Term] id: CHEBI:140774 name: 4-[(1->4)-alpha-D-glucosyl]n-D-glucose subset: chebi_ph7_3 is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:140775 name: 1-[(1->4)-alpha-D-glucosyl]n-alpha-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:140785 name: R-cob(III)alamin subset: chebi_ph7_3 is_a: CHEBI:23333 ! cob(III)alamins [Term] id: CHEBI:140810 name: beta-D-glucosamine(1+) subset: chebi_ph7_3 is_a: CHEBI:58723 ! 2-ammonio-2-deoxy-D-glucopyranose [Term] id: CHEBI:140817 name: alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:36508 ! glycotriaosylceramide is_a: CHEBI:78257 ! isogloboside [Term] id: CHEBI:14086 name: dTDP-D-galactose is_a: CHEBI:15848 ! dTDP-galactose [Term] id: CHEBI:140883 name: TG(18:2/18:2/18:2) subset: chebi_ph7_3 is_a: CHEBI:85876 ! triacylglycerol 54:6 [Term] id: CHEBI:140921 name: Hedgehog signaling pathway inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:140922 name: glioma-associated oncogene inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:140948 name: fatty acid 18:1 is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:140949 name: fatty acid 18:2 is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:140991 name: omega-methyl-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion [Term] id: CHEBI:140992 name: omega-hydroxy-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76307 ! omega-hydroxy fatty acid anion [Term] id: CHEBI:140997 name: omega-hydroxy-long-chain fatty acid is_a: CHEBI:10615 ! omega-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:141003 name: 4-[(1S,3aR,4S,6aR)-4-(1,3-benzodioxol-5-yl)tetrahydrofuro[3,4-c]furan-1-yl]-2-methoxyphenol subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:47790 ! furofuran relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:141004 name: alpha-D-galacturonosyl-(1->4)-D-galacturonate(2-) subset: chebi_ph7_3 is_a: CHEBI:28737 ! digalacturonate is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:141005 name: (6S)-5,6,7,8-tetrahydrofolyl-poly(gamma-glutamate) macromolecule subset: chebi_ph7_3 is_a: CHEBI:53309 ! polyanionic macromolecule is_a: CHEBI:58580 ! tetrahydrofolyl-poly(glutamate) macromolecule [Term] id: CHEBI:141006 name: alpha-D-GalpA-(1->4)-D-GalpA is_a: CHEBI:33809 ! digalacturonic acid [Term] id: CHEBI:141013 name: cob(II)inamide subset: chebi_ph7_3 is_a: CHEBI:23390 ! cobalt-corrinoid hexaamide [Term] id: CHEBI:141014 name: a pyrimidine ribonucleoside subset: chebi_ph7_3 is_a: CHEBI:18254 ! ribonucleoside [Term] id: CHEBI:141020 name: cyclooctat-9-en-5,7-diol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:141023 name: 2,3,6-trichloro-4-hydroxyphenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:141024 name: 2,6-dichloro-4-hydroxyphenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:14105 name: deamido-NAD zwitterion is_a: CHEBI:37584 ! nicotinic acid dinucleotide [Term] id: CHEBI:141129 name: N(6)-tetradecanoyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:189854 ! N(6)-(fatty acyl)-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:141131 name: acyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:141140 name: medium-chain fatty acyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:83622 ! fatty acyl-AMP(1-) [Term] id: CHEBI:141211 name: (R)-3-hydroxyisobutyrate subset: chebi_ph7_3 is_a: CHEBI:11805 ! 3-hydroxyisobutyrate [Term] id: CHEBI:141212 name: (R)-methylmalonate semialdehyde subset: chebi_ph7_3 is_a: CHEBI:57700 ! 2-methyl-3-oxopropanoate [Term] id: CHEBI:141249 name: N-carbamoyl-D-phenylglycine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:141283 name: (6E)-nerolidol subset: chebi_ph7_3 is_a: CHEBI:7524 ! nerolidol [Term] id: CHEBI:141434 name: monoacyl-3-O-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:14148 name: dihydrodipicolinate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:141486 name: (2R)-4-(2-ammonio-1-hydroxyethyl)phenol subset: chebi_ph7_3 is_a: CHEBI:50048 ! phenylethylamine is_a: CHEBI:58025 ! octopaminium [Term] id: CHEBI:141492 name: (3S)-3-hydroxy-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:141495 name: 4-hydroxy-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:141496 name: 4-hydroxy-L-lysine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:141498 name: hemiaminal ether is_a: CHEBI:36963 ! organooxygen compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:141499 name: (3S)-3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine(1+) subset: chebi_ph7_3 is_a: CHEBI:57515 ! 3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine zwitterion [Term] id: CHEBI:14158 name: dihydromonacolin L subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:141610 name: 3-hydroxy-D-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:141616 name: hapalindole-type alkaloid is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:141617 name: hapalindole is_a: CHEBI:141616 ! hapalindole-type alkaloid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:141619 name: fischerindole alkaloid is_a: CHEBI:141616 ! hapalindole-type alkaloid [Term] id: CHEBI:141668 name: L-tyrosinal(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:141697 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(5-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:141698 name: L,L-homocystine is_a: CHEBI:17485 ! homocystine [Term] id: CHEBI:141711 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(4-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:141724 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:141743 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:141748 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:141772 name: 2-hydroxydodecanoate subset: chebi_ph7_3 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:14178 name: 1D-myo-inositol bis(diphosphate) tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate is_a: CHEBI:64604 ! diphosphoinositol polyphosphate [Term] id: CHEBI:141790 name: 3-hydroxybutane-1,2,3-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:141817 name: 5-hydroxy-L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:141828 name: 3-hydroxy-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:32664 ! asparagine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:141847 name: 5'-end GMP-ribonucleotide(3-) residue subset: chebi_ph7_3 is_a: CHEBI:141856 ! 5'-end NMP-ribonucleotide(3-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:141855 name: 5'-end NTP-ribonucleotide(5-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:141856 name: 5'-end NMP-ribonucleotide(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:141992 name: 2-hydroxyflavanones subset: chebi_ph7_3 is_a: CHEBI:24697 ! hydroxyflavanone is_a: CHEBI:38131 ! lactol [Term] id: CHEBI:141994 name: (2S)-2-hydroxynaringenin subset: chebi_ph7_3 is_a: CHEBI:142230 ! 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one [Term] id: CHEBI:141995 name: (2S)-2-hydroxyeriodictyol subset: chebi_ph7_3 is_a: CHEBI:142228 ! 2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one [Term] id: CHEBI:141996 name: (2S)-2-hydroxypinocembrin subset: chebi_ph7_3 is_a: CHEBI:142232 ! 2,5,7-trihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one [Term] id: CHEBI:141997 name: hydroxy-L-argininium residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142054 name: 3-hydroxyaspartic acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:142057 name: 3-hydroxy-L-aspartic acid residue is_a: CHEBI:142054 ! 3-hydroxyaspartic acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142058 name: F2-isoprostane is_a: CHEBI:138408 ! isoprostane relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:142091 name: (-)-eremophilene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin [Term] id: CHEBI:142095 name: sideretin (reduced form) subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite [Term] id: CHEBI:142106 name: 5,6-dihydrouridine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:27232 ! uridine 5'-phosphate [Term] id: CHEBI:142110 name: 8-methylmenaquinone subset: chebi_ph7_3 is_a: CHEBI:25185 ! menaquinones [Term] id: CHEBI:142126 name: (E)-sinapaldehyde 4-O-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23245 ! cinnamaldehydes is_a: CHEBI:51681 ! dimethoxybenzene is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:142138 name: 4-hydroxy-indole-3-carbonyl nitrile subset: chebi_ph7_3 is_a: CHEBI:51852 ! alpha-ketonitrile is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite [Term] id: CHEBI:142139 name: indole-3-carbonyl nitrile subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:51852 ! alpha-ketonitrile relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite [Term] id: CHEBI:14216 name: erythrulose 1-phosphate is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:24980 ! ketotetrose phosphate [Term] id: CHEBI:142163 name: 24G7 epitope is_a: CHEBI:24433 ! group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142198 name: purine 2'-deoxyribonucleoside 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) [Term] id: CHEBI:142209 name: pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) [Term] id: CHEBI:142227 name: (2R)-2-hydroxyeriodictyol subset: chebi_ph7_3 is_a: CHEBI:142228 ! 2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one [Term] id: CHEBI:142228 name: 2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one subset: chebi_ph7_3 is_a: CHEBI:141992 ! 2-hydroxyflavanones is_a: CHEBI:38745 ! pentahydroxyflavanone [Term] id: CHEBI:142229 name: (2R)-2-hydroxynaringenin subset: chebi_ph7_3 is_a: CHEBI:142230 ! 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:142230 name: 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one subset: chebi_ph7_3 is_a: CHEBI:141992 ! 2-hydroxyflavanones is_a: CHEBI:38742 ! tetrahydroxyflavanone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:142231 name: (2R)-2-hydroxypinocembrin subset: chebi_ph7_3 is_a: CHEBI:142232 ! 2,5,7-trihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one [Term] id: CHEBI:142232 name: 2,5,7-trihydroxy-2-phenyl-2,3-dihydro-4H-chromen-4-one subset: chebi_ph7_3 is_a: CHEBI:141992 ! 2-hydroxyflavanones is_a: CHEBI:38739 ! trihydroxyflavanone [Term] id: CHEBI:142235 name: Se-L-selenocysteine-S-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:26629 ! selenoamino acid [Term] id: CHEBI:142279 name: sesquiterpene phytoalexin is_a: CHEBI:180906 ! terpenoid phytoalexin is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:142345 name: ditrans,polycis-dodecaprenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:142348 name: hexahydronaphthalenes is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:142355 name: purines D-ribonucleoside subset: chebi_ph7_3 is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:142361 name: purines 2'-deoxy-D-ribonucleoside subset: chebi_ph7_3 is_a: CHEBI:19254 ! purine 2'-deoxyribonucleoside is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142378 name: ditrans,polycis-dodecaprenyl phosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:142384 name: fatty acid 14:2 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:142389 name: trans-feruloylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:71221 ! feruloylacetyl-CoA(4-) [Term] id: CHEBI:142396 name: trans-feruloylacetyl-CoA is_a: CHEBI:71236 ! feruloylacetyl-CoA [Term] id: CHEBI:142398 name: trans-2,4-dihydroxy-cinnamoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:142409 name: S-alkyl-L-cysteine S-oxide zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:142410 name: guanosine 3'-diphosphate 5'-triphosphate hexaanion subset: chebi_ph7_3 is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:142422 name: gamma-carboxy-L-glutamate(3-) is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:142448 name: beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:144378 ! N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:23073 ! glycopentaosylceramide [Term] id: CHEBI:142460 name: alpha-D-Glcp-(1->2)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:142464 name: 8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:142482 name: 3'-hydro-2'-hydroxy-beta-oxodihydrochalcone subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142491 name: R-H subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142493 name: (3S,4R,5R,6S)-1,3,4,5,6-pentachlorocyclohexene subset: chebi_ph7_3 is_a: CHEBI:23139 ! chlorocyclohexene [Term] id: CHEBI:142508 name: beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group subset: chebi_ph7_3 is_a: CHEBI:30697 ! beta-D-glucosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142510 name: isonocardicin A zwitterion is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:142512 name: poly[(1''->2')-ADP-alpha-D-ribose] subset: chebi_ph7_3 is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:142513 name: oxime anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:142514 name: ->8)-alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-yl group is_a: CHEBI:33247 ! organic group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142515 name: 6-N-(ADP-D-ribosyl)-L-lysinium(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142518 name: beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group subset: chebi_ph7_3 is_a: CHEBI:30697 ! beta-D-glucosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142522 name: beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-R group is_a: CHEBI:33247 ! organic group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142525 name: 3-hydroxybutane-1,2,3-tricarboxylic acid is_a: CHEBI:25311 ! methylisocitric acid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:142532 name: alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group is_a: CHEBI:30697 ! beta-D-glucosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142533 name: ->4)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group subset: chebi_ph7_3 is_a: CHEBI:33247 ! organic group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142544 name: tamsulosin(1+) subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion [Term] id: CHEBI:142546 name: 5-(2-\{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide is_a: CHEBI:35358 ! sulfonamide is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:142548 name: ent-tamsulosin is_a: CHEBI:142546 ! 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide [Term] id: CHEBI:142549 name: ent-tamsulosin(1+) subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion [Term] id: CHEBI:142554 name: N(omega)-(ADP-D-ribosyl)-L-argininium(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142556 name: O-(ADP-D-ribosyl)-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142557 name: O-(ADP-D-ribosyl)-L-tyrosine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:142558 name: C-terminal O-(ADP-D-ribosyl)-glycine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:33713 ! C-terminal alpha-amino-acid residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:142567 name: alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group subset: chebi_ph7_3 is_a: CHEBI:30697 ! beta-D-glucosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142568 name: beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-yl group subset: chebi_ph7_3 is_a: CHEBI:16289 ! beta-D-galactosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142582 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:36520 ! oligoglycosylceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142587 name: N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142590 name: 3-aminoisobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:142594 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142607 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:14261 name: feruloyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:142621 name: medium-chain fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:142622 name: primary fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24026 ! fatty alcohol [Term] id: CHEBI:142626 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:142638 name: nectriapyrones is_a: CHEBI:26188 ! polyketide is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:14268 name: flavonol 3-O-glycoside subset: chebi_ph7_3 is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:142686 name: aldehydo-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:15748 ! D-glucuronate [Term] id: CHEBI:1427 name: 3-(3-hydroxyphenyl)propanoic acid is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:14272 name: fluoroacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:37143 ! organofluorine compound relationship: has_role CHEBI:50912 ! cardiotoxic agent [Term] id: CHEBI:142734 name: N-acyl hemiaminal subset: chebi_ph7_3 is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:142767 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-yl group is_a: CHEBI:30697 ! beta-D-glucosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:142768 name: C-terminal Xaa-(2S)-hydroxyglycino(1-) residue subset: chebi_ph7_3 is_a: CHEBI:137003 ! C-terminal Xaa-hydroxyglycino(1-) residue [Term] id: CHEBI:142796 name: 5-methyl-CMP(2-) subset: chebi_ph7_3 is_a: CHEBI:138238 ! pyrimidine ribonucleoside 5'-monophosphate(2-) [Term] id: CHEBI:142797 name: TMP(2-) subset: chebi_ph7_3 is_a: CHEBI:138238 ! pyrimidine ribonucleoside 5'-monophosphate(2-) [Term] id: CHEBI:14280 name: formyl phosphate(1-) is_a: CHEBI:60199 ! acyl monophosphate(1-) [Term] id: CHEBI:142821 name: andrastin C(1-) subset: chebi_ph7_3 is_a: CHEBI:142839 ! enolate relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor [Term] id: CHEBI:142822 name: andrastin B(1-) subset: chebi_ph7_3 is_a: CHEBI:142839 ! enolate relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor [Term] id: CHEBI:142823 name: andrastin A(1-) subset: chebi_ph7_3 is_a: CHEBI:142839 ! enolate relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor [Term] id: CHEBI:142839 name: enolate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:142842 name: andrastin A is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:136889 ! 5beta steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:33823 ! enol is_a: CHEBI:38089 ! 15-hydroxy steroid is_a: CHEBI:38149 ! 19-oxo steroid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:142848 name: 4alpha-hydroxymethyl-5alpha-ergosta-7,24(28)-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:142849 name: 4alpha-formyl-ergosta-7,24(28)-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:145954 ! 4alpha-formyl steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:142850 name: 3beta-hydroxy-5alpha-ergosta-7,24(28)-diene-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:142851 name: 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid is_a: CHEBI:26044 ! phosphinic acids is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:142852 name: glufosinate-P is_a: CHEBI:142851 ! 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid relationship: has_role CHEBI:24319 ! EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:33286 ! agrochemical [Term] id: CHEBI:142853 name: (2R)-glufosinate is_a: CHEBI:142851 ! 2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid [Term] id: CHEBI:142854 name: (2R)-glufosinate zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:142856 name: glufosinate-P zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:142858 name: (2R)-glufosinate zwitterion(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:142859 name: glufosinate-P zwitterion(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:142862 name: andrastin B is_a: CHEBI:136889 ! 5beta steroid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:33823 ! enol is_a: CHEBI:36842 ! 19-hydroxy steroid is_a: CHEBI:38089 ! 15-hydroxy steroid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:142864 name: 1-carboxybiuret(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:142867 name: andrastin C is_a: CHEBI:136889 ! 5beta steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:33823 ! enol is_a: CHEBI:38089 ! 15-hydroxy steroid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:142880 name: 7,2'-dihydroxy-4'-methoxyisoflavanol subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:76250 ! hydroxyisoflavans is_a: CHEBI:77002 ! methoxyisoflavan relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:142915 name: cycloeucalenone subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:142916 name: 4alpha-carboxy-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol(1-) subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:142917 name: 24-methylene-9beta-9,19-cyclolanostane-3beta,28-diol subset: chebi_ph7_3 is_a: CHEBI:131637 ! lanostane sterol is_a: CHEBI:145351 ! 3beta-hydroxy-4alpha-hydroxymethyl-4beta-methylsteroid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26125 ! phytosterols [Term] id: CHEBI:142918 name: 3beta-hydroxy-24-methylene-9beta-9,19-cyclolanostan-28-al subset: chebi_ph7_3 is_a: CHEBI:131637 ! lanostane sterol is_a: CHEBI:145353 ! 3beta-hydroxy-4alpha-formyl-4beta-methylsteroid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26125 ! phytosterols [Term] id: CHEBI:142919 name: 4alpha-carboxy-stigmasta-7,24(24(1))-dien-3beta-ol(1-) subset: chebi_ph7_3 is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:142921 name: 3-phenylprop-2-enal subset: chebi_ph7_3 is_a: CHEBI:23245 ! cinnamaldehydes [Term] id: CHEBI:142928 name: 4alpha-hydroxymethyl-stigmasta-7,24(24(1))-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:142929 name: (24Z)-4alpha-formyl-stigmasta-7,24(24(1))-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:145954 ! 4alpha-formyl steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:142938 name: gentamycin 2''-phosphate is_a: CHEBI:23666 ! diamine is_a: CHEBI:37549 ! glycoside phosphate is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:142939 name: 5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate(11-) subset: chebi_ph7_3 is_a: CHEBI:18087 ! myo-inositol polyphosphate is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:142940 name: dihexadecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:85688 ! diacylglycerol 32:0 [Term] id: CHEBI:142953 name: didodecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:142954 ! diacylglycerol 24:0 is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:142954 name: diacylglycerol 24:0 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:142967 name: D-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:62031 ! polar amino acid zwitterion [Term] id: CHEBI:142990 name: cyclolaudenol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:143004 name: ultra-long-chain fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid [Term] id: CHEBI:143005 name: ultra-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion [Term] id: CHEBI:143017 name: ultra-long-chain fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:143018 name: ultra-long-chain fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:143024 name: 1-carboxybiuret is_a: CHEBI:36954 ! condensed ureas [Term] id: CHEBI:143075 name: L-homocarnosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:143076 name: N(pros)-methyl-L-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:143079 name: D-leucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:143080 name: D-norleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:143081 name: D-homoserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:143084 name: organometalloidal compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143087 name: 1-stearoyl-2-(9,10-epoxyoctadecanoyl)-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:143089 name: 10-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:143092 name: 1-palmitoyl-2-(9,10-epoxyoctadecanoyl)-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:143093 name: 2'-3'-cGAMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:143095 name: 10-hydroxyoctadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:143097 name: Gp[2'-5']Ap[3'] is_a: CHEBI:61295 ! guanyl ribonucleotide is_a: CHEBI:61296 ! adenyl ribonucleotide is_a: CHEBI:75800 ! (2'->5')-dinucleotide [Term] id: CHEBI:143098 name: Gp[2'-5']Ap[3'](3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:143129 name: primary fatty amide subset: chebi_ph7_3 is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:143136 name: succinamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:14314 name: D-glucose 6-phosphate is_a: CHEBI:17348 ! D-aldohexose 6-phosphate is_a: CHEBI:21006 ! D-glucose monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:143197 name: culmorin subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:143199 name: S-myristoyl-L-cysteine group subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143200 name: S-stearoyl-L-cysteine group subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143201 name: S-oleoyl-L-cysteine group subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143202 name: S-arachidonoyl-L-cysteine group subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:14321 name: glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:143253 name: N(6)-(D-fructosyl)-L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:29969 ! L-lysinium residue [Term] id: CHEBI:143254 name: N(6)-(3-O-phospho-D-fructosyl)-L-lysinium(1-) residue subset: chebi_ph7_3 is_a: CHEBI:29969 ! L-lysinium residue [Term] id: CHEBI:143274 name: indole-3-butyrate subset: chebi_ph7_3 is_a: CHEBI:38468 ! indol-3-yl carboxylic acid anion [Term] id: CHEBI:143276 name: 4-chloro-L-lysinium subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:143285 name: L-propargylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:143286 name: L-gamma-glutamyl-L-propargylglycine(1-) subset: chebi_ph7_3 is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:143287 name: L-gamma-glutamyl-(3R)-L-beta-ethynylserine(1-) subset: chebi_ph7_3 is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:14336 name: glycerol 1-phosphate is_a: CHEBI:16890 ! glycerol monophosphate relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:143516 name: ultra-long-chain 3-oxoacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:143529 name: (2E)-decenoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion [Term] id: CHEBI:143532 name: prostaglandin F2alpha-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:143535 name: S-acyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:143553 name: 8-oxo-GTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) [Term] id: CHEBI:143554 name: 8-oxo-GDP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) [Term] id: CHEBI:143563 name: 3beta-hydroxy-4,4-dimethylsteroid subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:143566 name: 3beta-hydroxy-4beta-hydroxymethyl-4alpha-methylsteroid subset: chebi_ph7_3 is_a: CHEBI:145945 ! 4beta-hydroxymethyl steroid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:143576 name: anthocyanidin betaine subset: chebi_ph7_3 is_a: CHEBI:138177 ! 4-unsubstituted 3-hydroxyanthocyanidin betaine [Term] id: CHEBI:143593 name: beta-galactosylceramide subset: chebi_ph7_3 is_a: CHEBI:36498 ! galactosylceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143597 name: pentanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:197507 ! short-chain fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol [Term] id: CHEBI:143624 name: D-galactofuranose subset: chebi_ph7_3 is_a: CHEBI:12936 ! D-galactose [Term] id: CHEBI:143701 name: enolpyruvoyl-2-diphospho-5'-guanosine(3-) subset: chebi_ph7_3 is_a: CHEBI:38717 ! carboxylic acid trianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:143703 name: thiogeraniol subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:29256 ! thiol is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:143705 name: dehydro coenzyme F420-0(3-) subset: chebi_ph7_3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:143788 name: N(1)-(5-phospho-beta-D-ribosyl)glycinamide(1-) subset: chebi_ph7_3 is_a: CHEBI:58457 ! N(1)-(5-phospho-D-ribosyl)glycinamide(1-) [Term] id: CHEBI:1438 name: 3-(methylthio)propionic acid is_a: CHEBI:59643 ! thia fatty acid relationship: has_role CHEBI:38231 ! phytotoxin [Term] id: CHEBI:143813 name: 1-radyl,2-acyl-sn-glycero-3-phospho-(1D-myo-2-acyl-inositol)(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143815 name: N-acetyl-alpha-D-glucosaminyl-(1->6)-(phosphatidyl)-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143816 name: alpha-D-glucosaminyl-(1->6)-(phosphatidyl)-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:143819 name: C-terminal amino acid residue(1-) subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:143829 name: 4-chloro-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:143830 name: 4-chloro-L-lysine zwitterion is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:143877 name: N-acetyl-L-tryptophanate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:143878 name: N-acetyl-D-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:143890 name: 2-ammonioethyl (2R)-2,3-dihydroxypropyl phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:26706 ! sn-glycerol 3-phosphates is_a: CHEBI:27369 ! zwitterion is_a: CHEBI:83408 ! sn-glycerophosphodiester(1-) [Term] id: CHEBI:143915 name: N(6)-(pyridoxal phosphate)-L-lysine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:143949 name: (R)-lavandulyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58820 ! lavandulyl diphosphate(3-) [Term] id: CHEBI:143954 name: gibberellin A53(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:143955 name: gibberellin A44 (2-) (diacid form) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:143956 name: gibberellin A15(2-) (diacid form) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:143957 name: gibberellin A24(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:143966 name: (2S)-homocitric acid is_a: CHEBI:17852 ! homocitric acid [Term] id: CHEBI:143978 name: 5'-end phospho-adenosine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:144019 ! 5'-end phospho-(purine-ribonucleoside)(2-) residue [Term] id: CHEBI:144019 name: 5'-end phospho-(purine-ribonucleoside)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:138282 ! 5'-end ribonucleotide(2-) residue [Term] id: CHEBI:144029 name: 5'-end NAD-phospho-ribonucleoside residue subset: chebi_ph7_3 is_a: CHEBI:138282 ! 5'-end ribonucleotide(2-) residue [Term] id: CHEBI:144045 name: (omega-1)-hydroxy-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:144051 name: 5'-end phospho-adenosine-phospho-ribonucleoside(3-) residue subset: chebi_ph7_3 is_a: CHEBI:144019 ! 5'-end phospho-(purine-ribonucleoside)(2-) residue [Term] id: CHEBI:144097 name: EC 1.4.3.2 (L-amino-acid oxidase) inhibitor is_a: CHEBI:76861 ! EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor [Term] id: CHEBI:144099 name: EC 2.6.1.2 (alanine transaminase) inhibitor is_a: CHEBI:76879 ! EC 2.6.1.* (transaminase) inhibitor [Term] id: CHEBI:14428 name: hyponitrous acid subset: chebi_ph7_3 is_a: CHEBI:33455 ! nitrogen oxoacid [Term] id: CHEBI:144315 name: 1-radyl-2-acyl-sn-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:14434 name: imidazole is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:144368 name: 1,2-diacyl-sn-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144370 name: 3-(2-isocyanovinyl)indole is_a: CHEBI:24828 ! indoles is_a: CHEBI:35353 ! isocyanide is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:144378 name: N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144413 name: Phospho-anandamide is_a: CHEBI:145538 ! N-acylethanolamine phosphate is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:144422 name: N-acetyl-alpha-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide [Term] id: CHEBI:144433 name: afzelin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:144435 name: quercetin 3,7-bis-O-alpha-L-rhamnoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:144436 name: petiolaroside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:144437 name: quercetin 3-O-beta-D-glucopyranoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:144490 name: (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:90887 ! 2-hydroxy-6-oxo-2,4-heptadienoate [Term] id: CHEBI:144503 name: 5-deoxy-alpha-D-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:149540 ! 5-deoxy-D-ribofuranose is_a: CHEBI:23635 ! deoxypentose [Term] id: CHEBI:144513 name: (2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoic acid is_a: CHEBI:90886 ! 2-hydroxy-6-oxo-2,4-heptadienoic acid [Term] id: CHEBI:144542 name: N-acetyl-beta-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144544 name: N-acetyl-beta-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(d18:0) subset: chebi_ph7_3 is_a: CHEBI:144542 ! N-acetyl-beta-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144550 name: alpha-D-mannosyl-4''-O-queuosine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:144554 name: 5'-phosphonucleoside 3'-diphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:16492 ! nucleoside 3'-phosphate [Term] id: CHEBI:144635 name: D-2,4-diaminobutyric acid is_a: CHEBI:64307 ! 2,4-diaminobutyric acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:144637 name: 4-hydroxy-D-proline is_a: CHEBI:20392 ! 4-hydroxyproline is_a: CHEBI:84185 ! D-proline derivative [Term] id: CHEBI:144644 name: a tetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:144645 name: an 11a-hydroxytetracyline zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:14469 name: isomethyleugenol subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:51681 ! dimethoxybenzene is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:144697 name: N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:144699 name: N-[(2S)-2-ammoniobutanoyl]glycinate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:1447 name: 3-acylpyruvic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:144703 name: N-palmitoyl-sphingoid base subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:144711 name: N-stearoyl-sphingoid base subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:144712 name: N-(very-long-chain fatty acyl)-sphingoid base subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:144713 name: N-(ultra-long-chain-acyl)-sphingoid base subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:144720 name: inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:74596 ! Ins-1-P-Cer-C(1-) [Term] id: CHEBI:144728 name: N-[(2S)-2-aminobutanoyl]glycine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:144729 name: L-beta-ethynylserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35221 ! antimetabolite [Term] id: CHEBI:144748 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144773 name: anthocyanidin 3-O-beta-D-glucoside 5-O-beta-D-[(6-O-(E)-4-coumaroyl)glucoside] betaine subset: chebi_ph7_3 is_a: CHEBI:138177 ! 4-unsubstituted 3-hydroxyanthocyanidin betaine is_a: CHEBI:77943 ! anthocyanidin 3-glucoside 5-[(6-O-4-hydroxycinnamoyl)glucoside] betaine [Term] id: CHEBI:144774 name: linoleoyl containing 1,2,3-triacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144775 name: delphinidin(1-) subset: chebi_ph7_3 is_a: CHEBI:143576 ! anthocyanidin betaine is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:144776 name: delphinidin 3-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:16307 ! anthocyanidin 3-O-beta-D-glucoside is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:144777 name: pelargonidin(1-) subset: chebi_ph7_3 is_a: CHEBI:143576 ! anthocyanidin betaine is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:144778 name: pelargonidin 3-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:16307 ! anthocyanidin 3-O-beta-D-glucoside is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:144784 name: omega-hydroxy-ultra-long chain fatty acylceramide subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144785 name: omega-linoleoyloxy-O-ultra-long chain acylceramide subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:144817 name: 2-ammonio-2-deoxy-D-galactopyranose subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:144829 name: tumour antigen is_a: CHEBI:59132 ! antigen [Term] id: CHEBI:144833 name: L-beta-ethynylserine is_a: CHEBI:73477 ! terminal acetylenic compound is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:144842 name: N(6)-methyl-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) [Term] id: CHEBI:144889 name: D-xylulofuranose subset: chebi_ph7_3 is_a: CHEBI:25901 ! pentose [Term] id: CHEBI:144897 name: 1-piperideinium subset: chebi_ph7_3 is_a: CHEBI:35286 ! iminium ion [Term] id: CHEBI:1449 name: 3-amino-2-oxopropyl phosphate is_a: CHEBI:36948 ! oxoalkyl phosphate [Term] id: CHEBI:144940 name: L-alanyl-AMP zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:144968 name: N(6)-(2-hydroxyisobutanoyl)-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:144969 name: 2''-O-(2-hydroxyisobutanoyl)-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:145015 name: 3''-O-propanoyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:145026 name: L-psicose subset: chebi_ph7_3 is_a: CHEBI:33951 ! psicose relationship: has_role CHEBI:22587 ! antiviral agent [Term] id: CHEBI:145037 name: hydroperoxy fatty ester is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:61051 ! lipid hydroperoxide [Term] id: CHEBI:145041 name: brassicasterol 3-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:145042 name: solasodine 3-beta-D-glucoside(1+) subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:145043 name: solasodine(1+) subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion relationship: has_role CHEBI:145047 ! antispermatogenic agent relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:145047 name: antispermatogenic agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:145078 name: 3-oxo aldehyde is_a: CHEBI:24960 ! ketoaldehyde [Term] id: CHEBI:145178 name: 1-O-octadecyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145187 ! 1-O-octadecyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:60520 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:145182 name: 1-O-(1Z-octadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:145187 name: 1-O-octadecyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60520 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:145217 name: epoxy steroid is_a: CHEBI:32955 ! epoxide is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:145231 name: N-(4-carboxy-4-oxobutanoyl)-L-ethylglycylglycine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:145240 name: 2-methylpyrrolidine is_a: CHEBI:38260 ! pyrrolidines relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145324 name: N(6)-lactoyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:145326 name: 2,3-dehydroamino acid is_a: CHEBI:23591 ! dehydroamino acid [Term] id: CHEBI:145340 name: 3beta-hydroxy-5alpha-ergosta-7,24(28)-diene-4alpha-carboxylic acid is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:145351 name: 3beta-hydroxy-4alpha-hydroxymethyl-4beta-methylsteroid subset: chebi_ph7_3 is_a: CHEBI:145944 ! 4alpha-hydroxymethyl steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:145353 name: 3beta-hydroxy-4alpha-formyl-4beta-methylsteroid subset: chebi_ph7_3 is_a: CHEBI:145954 ! 4alpha-formyl steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:145390 name: N(6)-lactoyl-L-lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine [Term] id: CHEBI:145391 name: N(6)-(2-hydroxyisobutanoyl)-L-lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine [Term] id: CHEBI:145394 name: 1,2-diacyl-sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:60523 ! phosphatidylglycerol(1-) [Term] id: CHEBI:145397 name: 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:145427 name: D-glucopyranose 6-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:145434 name: oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72388 ! lysophosphatidylethanolamine zwitterion 18:1 [Term] id: CHEBI:145436 name: D-glucopyranose 6-sulfate is_a: CHEBI:24589 ! monosaccharide sulfate [Term] id: CHEBI:145437 name: uncoupling protein inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:145470 name: sophoroside subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:145497 name: N-acylethanolamine phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:145538 name: N-acylethanolamine phosphate is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:145543 name: viteagnusin D subset: chebi_ph7_3 is_a: CHEBI:134397 ! tertiary allylic alcohol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145544 name: S-nitrosoglutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:145545 name: nitrosothio compound subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:35800 ! nitroso compound [Term] id: CHEBI:145549 name: labd-13(16),14-diene-9-ol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:145550 name: peregrinol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145552 name: labd-13Z-ene-9,15,16-triol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27136 ! triol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:145555 name: macropolylide is_a: CHEBI:25106 ! macrolide [Term] id: CHEBI:145556 name: macrodiolide is_a: CHEBI:145555 ! macropolylide [Term] id: CHEBI:145559 name: macrotriolide is_a: CHEBI:145555 ! macropolylide [Term] id: CHEBI:145565 name: macrolide lactam is_a: CHEBI:24995 ! lactam is_a: CHEBI:25106 ! macrolide [Term] id: CHEBI:145566 name: syn-isopimara-7,15-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:145656 name: galactoxylomannan is_a: CHEBI:72813 ! exopolysaccharide relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:145663 name: 2-(beta-D-glucopyranosyloxy)benzoic acid is_a: CHEBI:87766 ! 2-(D-glucosyloxy)benzoic acid relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145670 name: 2-(beta-D-glucopyranosyloxy)benzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:145681 name: beta-D-glucosyl salicylate subset: chebi_ph7_3 is_a: CHEBI:133564 ! D-glucosyl salicylate is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:145694 name: 8-oxo-GMP(2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:145707 name: glycosylarabinose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:145715 name: hex-3-en-1-ol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:50582 ! alkenyl alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145735 name: (Z)-3-amino-2-methylacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:145742 name: (Z)-3-amino-2-methylacrylic acid is_a: CHEBI:47989 ! enamine is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:145806 name: (R)-(+)-perillyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15420 ! perillyl alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:145813 name: D-cystine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35492 ! cystine zwitterion [Term] id: CHEBI:145814 name: EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitor is_a: CHEBI:76852 ! EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:145853 name: N(6)-methyl-2'-O-methyladenosine monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:82882 ! 2'-O-methylnucleotide 5'-phosphate(1-) residue [Term] id: CHEBI:145902 name: 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:50526 ! phenolate [Term] id: CHEBI:145927 name: 4-(indol-3-yl)butanoyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:24821 ! indolyl carbohydrate is_a: CHEBI:46939 ! indolyl carboxylate ester is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:145932 name: (S)-2-methylbutanoate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:83976 ! 2-methyl fatty acid anion [Term] id: CHEBI:145942 name: 4alpha-formyl-5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:145943 name: 4alpha-carboxy-5alpha-cholest-7-en-3beta-ol(1-) subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:145944 name: 4alpha-hydroxymethyl steroid subset: chebi_ph7_3 is_a: CHEBI:145951 ! 4-hydroxymethylsteroid [Term] id: CHEBI:145945 name: 4beta-hydroxymethyl steroid subset: chebi_ph7_3 is_a: CHEBI:145951 ! 4-hydroxymethylsteroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:145946 name: N-acetyl-D-leucinate subset: chebi_ph7_3 is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:145947 name: antiatherosclerotic agent is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:145951 name: 4-hydroxymethylsteroid subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:145952 name: 4-formyl steroid subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde [Term] id: CHEBI:145954 name: 4alpha-formyl steroid subset: chebi_ph7_3 is_a: CHEBI:145952 ! 4-formyl steroid [Term] id: CHEBI:14597 name: methylarsonite is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:145989 name: 3-phosphonatoshikimate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:145992 name: orlandin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:146007 name: (M)-viriditoxin subset: chebi_ph7_3 is_a: CHEBI:146015 ! dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:146008 name: semiviriditoxin subset: chebi_ph7_3 is_a: CHEBI:146280 ! naphtho-alpha-pyrone is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:33853 ! phenols is_a: CHEBI:59872 ! heptaketide relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:146014 name: binaphthopyran is_a: CHEBI:64459 ! biaryl [Term] id: CHEBI:146015 name: dimethyl 2,2'-(9,9',10,10'-tetrahydroxy-7,7'-dimethoxy-1,1'-dioxo-3,3',4,4'-tetrahydro-[6,6'-binaphtho[2,3-c]pyran]-3,3'-diyl)diacetate subset: chebi_ph7_3 is_a: CHEBI:146014 ! binaphthopyran is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36820 ! ring assembly [Term] id: CHEBI:146021 name: N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:146022 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:1461 name: 3-butynoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:73477 ! terminal acetylenic compound [Term] id: CHEBI:146140 name: 4alpha-hydroxymethyl-4beta-methyl-5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:146176 name: levomethorphan is_a: CHEBI:146178 ! 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene relationship: has_role CHEBI:35482 ! opioid analgesic relationship: has_role CHEBI:50266 ! prodrug [Term] id: CHEBI:146178 name: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:83818 ! morphinane-like compound [Term] id: CHEBI:146179 name: galactotriose is_a: CHEBI:24151 ! galactooligosaccharide is_a: CHEBI:27150 ! trisaccharide is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:146180 name: glucotriose is_a: CHEBI:24268 ! glucooligosaccharide is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:146181 name: mannotriose is_a: CHEBI:25174 ! mannooligosaccharide is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:146199 name: S-(S-glutathionyl)-L-cysteine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:29950 ! L-cysteine residue [Term] id: CHEBI:146212 name: ilicicolin is_a: CHEBI:26188 ! polyketide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:146234 name: N(1)-methyl-N(3)-[(3S)-3-amino-3-carboxypropyl]-pseudouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:146270 name: oneirogen is_a: CHEBI:35471 ! psychotropic drug [Term] id: CHEBI:146280 name: naphtho-alpha-pyrone is_a: CHEBI:86027 ! naphthopyran [Term] id: CHEBI:146281 name: anthracenone is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46955 ! anthracenes [Term] id: CHEBI:146288 name: 8-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:146289 name: 9-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:146290 name: 9(S)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:146289 ! 9-HPETE(1-) [Term] id: CHEBI:146291 name: 11-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:146293 name: 9-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) [Term] id: CHEBI:146296 name: N-acetyl-D-leucine is_a: CHEBI:21501 ! N-acetyl-D-amino acid is_a: CHEBI:84114 ! D-leucine derivative [Term] id: CHEBI:146306 name: partially-defined glycan is_a: CHEBI:78616 ! carbohydrates and carbohydrate derivatives [Term] id: CHEBI:146448 name: beta-D-Xylp-(1->6)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:14648 name: NMN(+) is_a: CHEBI:50383 ! nicotinamide mononucleotide [Term] id: CHEBI:14649 name: NMN(-) subset: chebi_ph7_3 is_a: CHEBI:50383 ! nicotinamide mononucleotide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:146500 name: D-Galp-(1->3)-D-GalpNAc subset: chebi_ph7_3 is_a: CHEBI:146306 ! partially-defined glycan is_a: CHEBI:22160 ! acetamides is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22484 ! galactosamine oligosaccharide [Term] id: CHEBI:1467 name: (2S)-2-isopropyl-3-oxosuccinic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:146781 name: mature microcin B18 zwitterion is_a: CHEBI:64627 ! microcin relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor [Term] id: CHEBI:1472 name: 3-chloro-cis,cis-muconic acid is_a: CHEBI:38428 ! 3-chloromuconic acid [Term] id: CHEBI:147285 name: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor is_a: CHEBI:76796 ! EC 3.4.22.* (cysteine endopeptidase) inhibitor [Term] id: CHEBI:147286 name: N(2)-formyl-N(1)-(5-phospho-beta-D-ribosyl)glycinamide(2-) subset: chebi_ph7_3 is_a: CHEBI:58426 ! N(2)-formyl-N(1)-(5-phospho-D-ribosyl)glycinamide(2-) [Term] id: CHEBI:147287 name: 2-formamido-N(1)-(5-O-phosphonato-beta-D-ribosyl)acetamidine subset: chebi_ph7_3 is_a: CHEBI:58478 ! 2-formamido-N(1)-(5-O-phosphonato-D-ribosyl)acetamidine [Term] id: CHEBI:147288 name: omega-hydroxy-ultra-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76307 ! omega-hydroxy fatty acid anion [Term] id: CHEBI:147297 name: omega-hydroxy-ultra-long-chain fatty acid is_a: CHEBI:10615 ! omega-hydroxy fatty acid [Term] id: CHEBI:147309 name: diarachidonoylglycerol subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:147330 name: biphenyl-2,2',3,3'-tetraol subset: chebi_ph7_3 is_a: CHEBI:24681 ! hydroxybiphenyls is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:147331 name: 2-propylphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:147332 name: 3-propylcatechol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:147334 name: 1-phosphatidyl-1D-myo-inositol anion derivative subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:147335 name: 1-phosphatidyl-1D-myo-inositol-3-phosphate anion derivative subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:147340 name: (2R)-2-hydroperoxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:64012 ! hydroperoxy fatty acid anion [Term] id: CHEBI:147341 name: fumigermin subset: chebi_ph7_3 is_a: CHEBI:142638 ! nectriapyrones is_a: CHEBI:33822 ! organic hydroxy compound relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:147343 name: 2-hydroperoxy fatty acid is_a: CHEBI:64009 ! hydroperoxy fatty acid [Term] id: CHEBI:147344 name: (2R)-hydroperoxy fatty acid is_a: CHEBI:147343 ! 2-hydroperoxy fatty acid [Term] id: CHEBI:147345 name: (2S)-hydroperoxy fatty acid is_a: CHEBI:147343 ! 2-hydroperoxy fatty acid [Term] id: CHEBI:147369 name: glucotetraose is_a: CHEBI:24268 ! glucooligosaccharide is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:14737 name: pantoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:147380 name: ecdysone 22-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:23893 ! ecdysone phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:14750 name: acetylacetone subset: chebi_ph7_3 is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:14885 name: prephytoene diphosphate is_a: CHEBI:23044 ! carotenoid is_a: CHEBI:36782 ! tetraterpenyl phosphate [Term] id: CHEBI:148869 name: alpha-D-galactosamine is_a: CHEBI:60312 ! 2-amino-2-deoxy-D-galactopyranose [Term] id: CHEBI:149 name: (-)-dihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:14919 name: N(6)-lipoyl-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:149304 name: L-galactofuranose subset: chebi_ph7_3 is_a: CHEBI:37618 ! L-galactose [Term] id: CHEBI:149429 name: xylotriose is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:149433 name: mannotetraose is_a: CHEBI:25174 ! mannooligosaccharide is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:149465 name: glucopentaose is_a: CHEBI:24268 ! glucooligosaccharide is_a: CHEBI:35369 ! pentasaccharide [Term] id: CHEBI:149468 name: (8S)-8-amino-7-oxononanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:57532 ! 8-amino-7-oxononanoic acid zwitterion [Term] id: CHEBI:149469 name: (7R,8S)-7,8-diammoniononanoate subset: chebi_ph7_3 is_a: CHEBI:58500 ! 7,8-diaminononanoate cation [Term] id: CHEBI:149473 name: (4R,5S)-dethiobiotin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:149484 name: chloroquine(2+) subset: chebi_ph7_3 is_a: CHEBI:137982 ! tertiary ammonium ion is_a: CHEBI:52837 ! quinolinium ion [Term] id: CHEBI:14949 name: N(6)-(S(8)-aminomethyldihydrolipoyl)-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:149498 name: (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative subset: chebi_ph7_3 is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:149499 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative subset: chebi_ph7_3 is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:149500 name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative subset: chebi_ph7_3 is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:149502 name: (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative subset: chebi_ph7_3 is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:149509 name: candesartan(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:149540 name: 5-deoxy-D-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:23635 ! deoxypentose [Term] id: CHEBI:149543 name: L-altrose is_a: CHEBI:37708 ! altrose [Term] id: CHEBI:149552 name: emetic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:149553 name: anticoronaviral agent is_a: CHEBI:22587 ! antiviral agent [Term] id: CHEBI:149554 name: C-terminal alpha-amino-acyl-L-glutamyl-L-glutamyl-L-tyrosinate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue is_a: CHEBI:33711 ! C-terminal amino-acid residue [Term] id: CHEBI:149555 name: C-terminal alpha-amino-acyl-L-glutamyl-L-glutamate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue is_a: CHEBI:33711 ! C-terminal amino-acid residue [Term] id: CHEBI:149591 name: (dihydroxyphenyl)propanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:149673 name: (1S,2R)-ephedrine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:149682 name: O-diphosphonato-L-serine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:149689 name: D-dopa zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:149690 name: N-(fatty acyl)-L-phenylalanine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion relationship: has_part CHEBI:28868 ! fatty acid anion relationship: has_part CHEBI:58095 ! L-phenylalanine zwitterion [Term] id: CHEBI:149714 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:14973 name: pyrazole is_a: CHEBI:26410 ! pyrazoles is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:149737 name: N-(fatty acyl)-L-methionine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:149740 name: N-(fatty acyl)-L-leucine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:25018 ! L-leucine derivative [Term] id: CHEBI:149741 name: N-(fatty acyl)-L-isoleucine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:149742 name: N-(fatty acyl)-glycine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:149743 name: N-(fatty acyl)-L-glutamine(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:87584 ! N(2)-acyl-L-glutaminate [Term] id: CHEBI:149759 name: 2-methyl-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:149778 name: methyl-L-glutamic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:149779 name: mannogen is_a: CHEBI:18154 ! polysaccharide relationship: has_role CHEBI:72316 ! virulence factor [Term] id: CHEBI:150 name: (-)-isodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol [Term] id: CHEBI:150013 name: emodin anthrone subset: chebi_ph7_3 is_a: CHEBI:146281 ! anthracenone is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:150018 name: 3-aminobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:15022 name: electron donor is_a: CHEBI:17891 ! donor [Term] id: CHEBI:15031 name: dihydroriboflavins is_a: CHEBI:30527 ! flavin [Term] id: CHEBI:15035 name: retinal subset: chebi_ph7_3 is_a: CHEBI:26534 ! retinals is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15036 name: retinoate subset: chebi_ph7_3 is_a: CHEBI:139589 ! retinoid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:15040 name: retinyl palmitate is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:22586 ! antioxidant [Term] id: CHEBI:15045 name: riboflavin cyclic 4',5'-phosphate is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:26554 ! ribitol phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:1506 name: 3-fumarylpyruvic acid is_a: CHEBI:47940 ! 4,6-dioxohept-2-enedioic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:15075 name: selenate subset: chebi_ph7_3 is_a: CHEBI:33488 ! selenium oxoanion is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15076 name: selenide is_a: CHEBI:36904 ! elemental selenium relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:150865 name: 2,4,6-trihydroxyphenylhexan-1-one subset: chebi_ph7_3 is_a: CHEBI:134316 ! 2-acylphloroglucinol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:151 name: D-threo-isocitric acid is_a: CHEBI:30887 ! isocitric acid [Term] id: CHEBI:15138 name: sulfide(2-) is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:151472 name: N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose is_a: CHEBI:22160 ! acetamides is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15172 name: tRNA(Asx) is_a: CHEBI:17843 ! transfer RNA [Term] id: CHEBI:15176 name: tRNA(Glx) is_a: CHEBI:17843 ! transfer RNA [Term] id: CHEBI:15193 name: tartrate(2-) is_a: CHEBI:30929 ! 2,3-dihydroxybutanedioate is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:152 name: (+)-neodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol [Term] id: CHEBI:15208 name: taxuyunnanin C subset: chebi_ph7_3 is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:15226 name: tetrathionate(2-) subset: chebi_ph7_3 is_a: CHEBI:26936 ! tetrathionate ion is_a: CHEBI:48154 ! sulfur oxide [Term] id: CHEBI:15237 name: thiomorpholine-3-carboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:36393 ! thiomorpholines [Term] id: CHEBI:15243 name: threonate is_a: CHEBI:49061 ! 2,3,4-trihydroxybutanoate [Term] id: CHEBI:15245 name: thymidine 5'-monophosphate is_a: CHEBI:27001 ! thymidine phosphate is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:152555 name: (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:15258 name: trichlorophenols is_a: CHEBI:23150 ! chlorophenol is_a: CHEBI:27096 ! trichlorobenzene [Term] id: CHEBI:15266 name: triphosphate ion is_a: CHEBI:33461 ! phosphorus oxoanion [Term] id: CHEBI:153 name: (-)-neoisodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol [Term] id: CHEBI:153066 name: (S)-oxalatosuccinate(3-) subset: chebi_ph7_3 is_a: CHEBI:58931 ! oxalatosuccinate(3-) [Term] id: CHEBI:153067 name: 2-[(E)-caffeoyl]-D-threo-isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:15318 name: xanthine is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:26386 ! purine nucleobase relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15333 name: zeatin subset: chebi_ph7_3 is_a: CHEBI:38643 ! 6-isopentenylaminopurine relationship: has_role CHEBI:23530 ! cytokinin [Term] id: CHEBI:15334 name: N(alpha)-methyl-L-tryptophan is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid is_a: CHEBI:47994 ! L-tryptophan derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15335 name: 5,7-dihydroxy-4'-methoxyflavone is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15337 name: beta-alanopine is_a: CHEBI:36164 ! amino dicarboxylic acid [Term] id: CHEBI:15339 name: acceptor is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:15341 name: beta-D-glucosiduronic acid is_a: CHEBI:24302 ! glucosiduronic acid [Term] id: CHEBI:15342 name: acenaphthoquinone subset: chebi_ph7_3 is_a: CHEBI:25622 ! orthoquinones relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:53431 ! chain carrier [Term] id: CHEBI:15343 name: acetaldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde relationship: has_role CHEBI:17654 ! electron acceptor relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:63248 ! oxidising agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor [Term] id: CHEBI:15344 name: acetoacetic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:73693 ! ketone body relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15345 name: acetoacetyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15346 name: coenzyme A is_a: CHEBI:37240 ! adenosine 3',5'-bisphosphate relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15347 name: acetone subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:26292 ! propanones is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:73693 ! ketone body relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor [Term] id: CHEBI:15348 name: 2-hydroxy-2-methylpropanenitrile subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin [Term] id: CHEBI:15349 name: acetone oxime subset: chebi_ph7_3 is_a: CHEBI:24983 ! ketoxime [Term] id: CHEBI:15350 name: acetyl dihydrogen phosphate is_a: CHEBI:16826 ! acyl monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15351 name: acetyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:35224 ! effector relationship: has_role CHEBI:62049 ! acyl donor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15353 name: blasticidin S is_a: CHEBI:22905 ! blasticidin is_a: CHEBI:86478 ! antibiotic antifungal agent relationship: has_role CHEBI:24127 ! fungicide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:15354 name: choline subset: chebi_ph7_3 is_a: CHEBI:23217 ! cholines relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:33284 ! nutrient relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:15355 name: acetylcholine subset: chebi_ph7_3 is_a: CHEBI:35287 ! acylcholine is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:24621 ! hormone relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:38325 ! muscarinic agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15356 name: cysteine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:50326 ! sulfanylmethyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:153569 name: (3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:15357 name: acetylenedicarboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:15358 name: histone is_a: CHEBI:36080 ! protein [Term] id: CHEBI:15360 name: acetylpyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:15361 name: pyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15362 name: hydroxyacetone phosphate is_a: CHEBI:36948 ! oxoalkyl phosphate [Term] id: CHEBI:15363 name: N-acetylindoxyl subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75884 ! N-acylindole is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:15364 name: propynoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:61380 ! acetylenic fatty acid anion [Term] id: CHEBI:15365 name: acetylsalicylic acid is_a: CHEBI:140310 ! phenyl acetates is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:26596 ! salicylates relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:49023 ! prostaglandin antagonist relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:50629 ! cyclooxygenase 2 inhibitor relationship: has_role CHEBI:50630 ! cyclooxygenase 1 inhibitor relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:73182 ! plant activator relationship: has_role CHEBI:77425 ! EC 1.1.1.188 (prostaglandin-F synthase) inhibitor relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:15366 name: acetic acid is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:64049 ! food acidity regulator relationship: has_role CHEBI:65256 ! antimicrobial food preservative relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:15367 name: all-trans-retinoic acid is_a: CHEBI:12777 ! vitamin A is_a: CHEBI:26536 ! retinoic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50176 ! keratolytic drug relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:63794 ! retinoid X receptor agonist relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:67198 ! retinoic acid receptor agonist relationship: has_role CHEBI:67199 ! AP-1 antagonist relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15368 name: acrolein subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:15369 name: actinomycin is_a: CHEBI:23239 ! chromopeptide [Term] id: CHEBI:15371 name: 3-oxopristanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:15372 name: 5,6,7,8-tetrahydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:22881 ! biopterins is_a: CHEBI:23824 ! diol is_a: CHEBI:30436 ! tetrahydropterin relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:26348 ! prosthetic group relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15373 name: biopterin subset: chebi_ph7_3 is_a: CHEBI:22881 ! biopterins relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15374 name: 4a-hydroxytetrahydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:30436 ! tetrahydropterin is_a: CHEBI:73080 ! hemiaminal relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15375 name: D-erythro-7,8-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:64277 ! 7,8-dihydrobiopterin [Term] id: CHEBI:15377 name: water subset: chebi_ph7_3 is_a: CHEBI:33693 ! oxygen hydride is_a: CHEBI:37176 ! mononuclear parent hydride is_a: CHEBI:52625 ! inorganic hydroxy compound relationship: has_role CHEBI:48360 ! amphiprotic solvent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76413 ! greenhouse gas relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15378 name: hydron subset: chebi_ph7_3 is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:33251 ! monoatomic hydrogen is_a: CHEBI:33252 ! atomic nucleus is_a: CHEBI:60242 ! monovalent inorganic cation [Term] id: CHEBI:15379 name: dioxygen subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:25362 ! elemental molecule is_a: CHEBI:33263 ! diatomic oxygen relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:33284 ! nutrient relationship: has_role CHEBI:33893 ! reagent relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:63248 ! oxidising agent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77974 ! food packaging gas [Term] id: CHEBI:15380 name: succinyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:35222 ! inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15382 name: (4R)-limonene subset: chebi_ph7_3 is_a: CHEBI:15384 ! limonene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15383 name: (4S)-limonene subset: chebi_ph7_3 is_a: CHEBI:15384 ! limonene [Term] id: CHEBI:15384 name: limonene subset: chebi_ph7_3 is_a: CHEBI:33643 ! cycloalkene is_a: CHEBI:50073 ! p-menthadiene relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15385 name: (+)-delta-cadinene subset: chebi_ph7_3 is_a: CHEBI:140564 ! delta-cadinene is_a: CHEBI:22976 ! cadinene [Term] id: CHEBI:15386 name: (3S,4R)-3,4-dihydrophenanthrene-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:23286 ! cis-3,4-dihydrophenanthrene-3,4-diol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15387 name: (+)-cis-sabinol subset: chebi_ph7_3 is_a: CHEBI:26590 ! sabinol [Term] id: CHEBI:15388 name: (+)-trans-carveol subset: chebi_ph7_3 is_a: CHEBI:23046 ! carveol [Term] id: CHEBI:15389 name: (-)-trans-carveol subset: chebi_ph7_3 is_a: CHEBI:23046 ! carveol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15390 name: (+)-bisdechlorogeodin subset: chebi_ph7_3 is_a: CHEBI:22899 ! bisdechlorogeodin [Term] id: CHEBI:15391 name: (-)-bisdechlorogeodin subset: chebi_ph7_3 is_a: CHEBI:22899 ! bisdechlorogeodin [Term] id: CHEBI:15392 name: (1R)-bornane-2,5-dione subset: chebi_ph7_3 is_a: CHEBI:36775 ! bornane-2,5-dione [Term] id: CHEBI:15393 name: (+)-borneol subset: chebi_ph7_3 is_a: CHEBI:28093 ! borneol [Term] id: CHEBI:15394 name: (-)-borneol subset: chebi_ph7_3 is_a: CHEBI:28093 ! borneol [Term] id: CHEBI:15395 name: (+)-bornyl diphosphate is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:25412 ! monoterpenyl phosphate [Term] id: CHEBI:15396 name: (R)-camphor subset: chebi_ph7_3 is_a: CHEBI:36773 ! camphor [Term] id: CHEBI:15397 name: (S)-camphor subset: chebi_ph7_3 is_a: CHEBI:36773 ! camphor [Term] id: CHEBI:15398 name: (+)-exo-5-hydroxycamphor subset: chebi_ph7_3 is_a: CHEBI:20570 ! 5-hydroxycamphor [Term] id: CHEBI:15399 name: (+)-carvone subset: chebi_ph7_3 is_a: CHEBI:38265 ! carvone [Term] id: CHEBI:154 name: (+)-dihydrocarvone subset: chebi_ph7_3 is_a: CHEBI:23733 ! dihydrocarvone [Term] id: CHEBI:15400 name: (-)-carvone subset: chebi_ph7_3 is_a: CHEBI:38265 ! carvone [Term] id: CHEBI:15401 name: (+)-dihydrokaempferol subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:38742 ! tetrahydroxyflavanone is_a: CHEBI:48039 ! dihydroflavonols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15402 name: (+)-neomenthol subset: chebi_ph7_3 is_a: CHEBI:25187 ! p-menthan-3-ol [Term] id: CHEBI:15403 name: (+)-sabinone subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:15404 name: (-)-homoisocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:30904 ! homoisocitrate(3-) [Term] id: CHEBI:15405 name: (-)-endo-fenchol subset: chebi_ph7_3 is_a: CHEBI:36739 ! fenchane monoterpenoid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15406 name: (-)-trans-isopiperitenol subset: chebi_ph7_3 is_a: CHEBI:24911 ! isopiperitenol [Term] id: CHEBI:15407 name: (-)-ephedrine is_a: CHEBI:25990 ! phenylethanolamines is_a: CHEBI:38605 ! phenethylamine alkaloid relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77715 ! nasal decongestant relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:15408 name: (-)-isopiperitenone subset: chebi_ph7_3 is_a: CHEBI:50110 ! isopiperitenone [Term] id: CHEBI:15409 name: (-)-menthol subset: chebi_ph7_3 is_a: CHEBI:25187 ! p-menthan-3-ol relationship: has_role CHEBI:51177 ! antitussive relationship: has_role CHEBI:53784 ! antispasmodic drug relationship: has_role CHEBI:59683 ! antipruritic drug [Term] id: CHEBI:15410 name: (-)-menthone subset: chebi_ph7_3 is_a: CHEBI:36503 ! menthone [Term] id: CHEBI:15411 name: (-)-menthyl beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:15412 name: (-)-ureidoglycolic acid is_a: CHEBI:49050 ! ureidoglycolic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15413 name: 2',4,4',6'-tetrahydroxychalcone is_a: CHEBI:23086 ! chalcones is_a: CHEBI:26195 ! polyphenol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50857 ! anti-allergic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:15414 name: S-adenosyl-L-methionine is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15415 name: ent-kaurene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:15416 name: ent-kaur-16-en-19-ol subset: chebi_ph7_3 is_a: CHEBI:36760 ! ent-kaurane diterpenoid [Term] id: CHEBI:15417 name: ent-kaur-16-en-19-oic acid is_a: CHEBI:36760 ! ent-kaurane diterpenoid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:64947 ! anti-HIV-1 agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15418 name: ent-kaur-16-en-19-al subset: chebi_ph7_3 is_a: CHEBI:36760 ! ent-kaurane diterpenoid [Term] id: CHEBI:15419 name: ent-7alpha-hydroxykaur-16-en-19-oic acid is_a: CHEBI:36760 ! ent-kaurane diterpenoid [Term] id: CHEBI:15420 name: perillyl alcohol subset: chebi_ph7_3 is_a: CHEBI:25040 ! limonene monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15421 name: perillyl aldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15422 name: ATP is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15423 name: clavaminic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:15424 name: dihydroclavaminic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:15425 name: proclavaminic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:15426 name: deoxyamidinoproclavaminic acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35627 ! beta-lactam is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:15427 name: N(2)-(2-carboxyethyl)-L-arginine is_a: CHEBI:22440 ! alpha-N-substituted L-arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:36164 ! amino dicarboxylic acid [Term] id: CHEBI:15428 name: glycine is_a: CHEBI:26650 ! serine family amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:64570 ! EC 2.1.2.1 (glycine hydroxymethyltransferase) inhibitor relationship: has_role CHEBI:64571 ! NMDA receptor agonist relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15429 name: hydroxylamine subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines relationship: has_role CHEBI:50566 ! nitric oxide donor relationship: has_role CHEBI:59740 ! nucleophilic reagent relationship: has_role CHEBI:63156 ! EC 1.1.3.13 (alcohol oxidase) inhibitor relationship: has_role CHEBI:63157 ! EC 4.2.1.22 (cystathionine beta-synthase) inhibitor relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:77090 ! EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:154293 name: alpha-D-GlcpNAc-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22485 ! glucosamine oligosaccharide [Term] id: CHEBI:15430 name: protoporphyrin is_a: CHEBI:26361 ! protoporphyrins relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15431 name: magnesium protoporphyrin is_a: CHEBI:25111 ! magnesium porphyrin is_a: CHEBI:36158 ! metalloprotoporphyrin [Term] id: CHEBI:15432 name: magnesium protoporphyrin 13-monomethyl ester subset: chebi_ph7_3 is_a: CHEBI:25111 ! magnesium porphyrin is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:15433 name: magnesium 13(1)-oxoprotoporphyrin 13-monomethyl ester subset: chebi_ph7_3 is_a: CHEBI:25111 ! magnesium porphyrin is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:15434 name: magnesium 13(1)-hydroxyprotoporphyrin 13-monomethyl ester is_a: CHEBI:25111 ! magnesium porphyrin is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:15435 name: protoporphyrinogen is_a: CHEBI:36321 ! porphyrinogens relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15437 name: uroporphyrinogen III is_a: CHEBI:27258 ! uroporphyrinogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15438 name: coproporphyrinogen is_a: CHEBI:35742 ! tetracarboxylic acid is_a: CHEBI:36321 ! porphyrinogens [Term] id: CHEBI:15439 name: coproporphyrinogen III is_a: CHEBI:15438 ! coproporphyrinogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15440 name: squalene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15441 name: (S)-2,3-epoxysqualene subset: chebi_ph7_3 is_a: CHEBI:78662 ! 2,3-epoxysqualene relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15442 name: presqualene diphosphate is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:36780 ! triterpenyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15443 name: inulin is_a: CHEBI:29084 ! (2->1)-beta-D-fructan [Term] id: CHEBI:15444 name: (1->4)-alpha-D-glucan subset: chebi_ph7_3 is_a: CHEBI:22385 ! alpha-D-glucan [Term] id: CHEBI:15446 name: [(1->4)-alpha-D-galacturonosyl]n is_a: CHEBI:37165 ! galactan [Term] id: CHEBI:15447 name: (1->4)-beta-D-xylan subset: chebi_ph7_3 is_a: CHEBI:37166 ! xylan is_a: CHEBI:61266 ! hemicellulose [Term] id: CHEBI:15448 name: (1-hydroxycyclohexyl)acetyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA [Term] id: CHEBI:15449 name: (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:24685 ! hydroxybutanoyl-CoA is_a: CHEBI:25286 ! methylbutanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15450 name: (2R)-2-methylacyl-CoA is_a: CHEBI:183511 ! 2-methylacyl-CoA [Term] id: CHEBI:15451 name: (2S)-2-methylacyl-CoA is_a: CHEBI:183511 ! 2-methylacyl-CoA [Term] id: CHEBI:15452 name: (R)-3-hydroxybutanoyl-CoA is_a: CHEBI:37050 ! 3-hydroxybutanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15453 name: (S)-3-hydroxybutanoyl-CoA is_a: CHEBI:37050 ! 3-hydroxybutanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15454 name: (3S)-3-carboxy-3-hydroxypropanoyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:15455 name: (S)-3-hydroxyacyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA [Term] id: CHEBI:15456 name: (R)-3-hydroxyacyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA [Term] id: CHEBI:15457 name: citramalyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA [Term] id: CHEBI:15459 name: (3S)-citryl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:15460 name: trans-tetradec-11-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:52831 ! Delta(11)-fatty acyl-CoA [Term] id: CHEBI:15461 name: cis-tetradec-11-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:26900 ! tetradecenoyl-CoA is_a: CHEBI:52831 ! Delta(11)-fatty acyl-CoA [Term] id: CHEBI:15463 name: cinnamoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15464 name: (E,E)-piperonyl-CoA is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:15465 name: (R)-methylmalonyl-CoA is_a: CHEBI:16625 ! methylmalonyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15466 name: (S)-methylmalonyl-CoA is_a: CHEBI:16625 ! methylmalonyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15467 name: (3S)-3-hydroxy-3-methylglutaryl-CoA is_a: CHEBI:11814 ! 3-hydroxy-3-methylglutaryl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15468 name: 3'-dephospho-CoA is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15469 name: alk-2-enoyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:1547 name: 3-hydroxykynurenine is_a: CHEBI:86497 ! hydroxykynurenine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15470 name: 2,4-dichlorobenzoyl-CoA is_a: CHEBI:23698 ! dichlorobenzoyl-CoA [Term] id: CHEBI:15471 name: trans-dodec-2-enoyl-CoA is_a: CHEBI:23869 ! dodecenoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15472 name: anthraniloyl-CoA is_a: CHEBI:22736 ! benzoyl-CoAs [Term] id: CHEBI:15473 name: crotonoyl-CoA is_a: CHEBI:36926 ! but-2-enoyl-CoA [Term] id: CHEBI:15474 name: 2-furoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15475 name: 2-hydroxyphytanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:15476 name: 2-methylacetoacetyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15477 name: 2-methylbutanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:15478 name: 2-methylcrotonoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:15479 name: isobutyryl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15480 name: 3-(4-methylpent-3-en-1-yl)pent-2-enedioyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:15481 name: 3-hydroxy-2-methylpropanoyl-CoA is_a: CHEBI:25336 ! methylpropanoyl-CoA [Term] id: CHEBI:15483 name: 3-hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA is_a: CHEBI:24333 ! glutaryl-CoAs [Term] id: CHEBI:15484 name: 3-hydroxybenzoyl-CoA is_a: CHEBI:24678 ! hydroxybenzoyl-CoA [Term] id: CHEBI:15485 name: 3-hydroxypimeloyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15486 name: 3-methylbut-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15487 name: isovaleryl-CoA is_a: CHEBI:25286 ! methylbutanoyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15488 name: trans-3-methylglutaconyl-CoA is_a: CHEBI:24311 ! glutaconyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15489 name: 3-oxo-fatty acyl-CoA is_a: CHEBI:61903 ! oxo-fatty acyl-CoA [Term] id: CHEBI:1549 name: 3-hydroxymonocarboxylic acid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:15490 name: 3-oxoadipyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15491 name: 3-oxopalmitoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15492 name: 3-oxopimeloyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15493 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15494 name: 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:48887 ! bile acid metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15495 name: 4,8,12-trimethyltridecanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:15496 name: 4-aminobutanoyl-CoA is_a: CHEBI:22500 ! aminobutanoyl-CoA [Term] id: CHEBI:15497 name: trans-4-carboxybut-2-enoyl-CoA is_a: CHEBI:24311 ! glutaconyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15498 name: 4-chlorobenzoyl-CoA is_a: CHEBI:23136 ! chlorobenzoyl-CoA is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:15499 name: 4-coumaroyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:155 name: (-)-isodihydrocarvone subset: chebi_ph7_3 is_a: CHEBI:23733 ! dihydrocarvone [Term] id: CHEBI:15500 name: 4-hydroxybenzoyl-CoA is_a: CHEBI:24678 ! hydroxybenzoyl-CoA [Term] id: CHEBI:15501 name: 5-hydroxypentanoyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:15502 name: 5-hydroxythiophene-2-carbonyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15503 name: 2,3-didehydropimeloyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:15504 name: pimeloyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15505 name: 6-hydroxycyclohex-1-ene-1-carbonyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA [Term] id: CHEBI:15507 name: beta-alanyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15508 name: gamma-linolenoyl-CoA is_a: CHEBI:139576 ! octadecatrienoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15509 name: 4-(2-carboxyphenyl)-4-oxobutanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15510 name: 5-hydroxy-2-furoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15511 name: trans-feruloyl-CoA is_a: CHEBI:14261 ! feruloyl-CoA [Term] id: CHEBI:15512 name: L-3-aminobutanoyl-CoA is_a: CHEBI:28317 ! 3-aminobutyryl-CoA [Term] id: CHEBI:15513 name: acryloyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15514 name: arachidonoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:76180 ! arachidonoyl bioconjugate [Term] id: CHEBI:15515 name: benzoyl-CoA is_a: CHEBI:22736 ! benzoyl-CoAs relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15516 name: biotinyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15517 name: butyryl-CoA is_a: CHEBI:22954 ! butanoyl-CoAs relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15518 name: caffeoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15519 name: choloyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs [Term] id: CHEBI:15520 name: cyclohexa-1,5-diene-1-carbonyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:15521 name: lauroyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15522 name: formyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15523 name: cis-geranoyl-CoA is_a: CHEBI:27803 ! cis-2-enoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15524 name: glutaryl-CoA is_a: CHEBI:24333 ! glutaryl-CoAs relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15525 name: palmitoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:65122 ! 3-substituted propionyl-CoA is_a: CHEBI:76194 ! palmitoyl bioconjugate is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15527 name: icosanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15528 name: itaconyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:20012 ! 3-enoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15529 name: lactoyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:15530 name: linoleoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA is_a: CHEBI:76186 ! linoleoyl bioconjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15531 name: malonyl-CoA is_a: CHEBI:25136 ! malonyl-CoAs relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:63158 ! EC 2.3.1.21 (carnitine O-palmitoyltransferase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15532 name: myristoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15533 name: octanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15534 name: oleoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15535 name: oxalyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15536 name: pentanoyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:15537 name: phenylacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15538 name: phytanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA [Term] id: CHEBI:15539 name: propionyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15540 name: sinapoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:15541 name: stearoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15542 name: thiophene-2-carbonyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:15543 name: vinylacetyl-CoA is_a: CHEBI:22961 ! butenoyl-CoA [Term] id: CHEBI:15544 name: prostaglandin E1 is_a: CHEBI:26338 ! prostaglandins E relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15545 name: prostaglandin A1 is_a: CHEBI:26334 ! prostaglandins A [Term] id: CHEBI:15546 name: prostaglandin C1 is_a: CHEBI:26336 ! prostaglandins C [Term] id: CHEBI:15547 name: 15-dehydro-prostaglandin E2 is_a: CHEBI:26338 ! prostaglandins E [Term] id: CHEBI:15548 name: 15-dehydro-prostaglandin E1 is_a: CHEBI:26338 ! prostaglandins E [Term] id: CHEBI:15550 name: 13,14-dihydro-15-oxo-prostaglandin E2 is_a: CHEBI:26338 ! prostaglandins E [Term] id: CHEBI:15551 name: prostaglandin E2 is_a: CHEBI:26338 ! prostaglandins E relationship: has_role CHEBI:36063 ! oxytocic relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15552 name: prostaglandin I2 is_a: CHEBI:26345 ! prostaglandins I relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15553 name: prostaglandin F2alpha is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36066 ! prostaglandins Falpha relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15554 name: prostaglandin H2 is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15555 name: prostaglandin D2 is_a: CHEBI:26337 ! prostaglandins D relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15556 name: 15-dehydro-prostaglandin I2 is_a: CHEBI:26345 ! prostaglandins I [Term] id: CHEBI:15557 name: 15-dehydro-prostaglandin D2 is_a: CHEBI:26337 ! prostaglandins D [Term] id: CHEBI:15558 name: 15(S)-HETE is_a: CHEBI:64017 ! (5Z,8Z,11Z,13E)-15-HETE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15559 name: 15-oxo-ETE is_a: CHEBI:61704 ! oxoicosatetraenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15560 name: (15Z)-12-oxophyto-10,15-dienoic acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:35744 ! carbocyclic fatty acid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:15561 name: cis-1,2-dihydronaphthalene-1,2-diol is_a: CHEBI:28516 ! 1,2-dihydronaphthalene-1,2-diol [Term] id: CHEBI:15562 name: D-threo-isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:16087 ! isocitrate(3-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15563 name: D-erythro-isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:16087 ! isocitrate(3-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15564 name: (3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid is_a: CHEBI:36194 ! cyclohexadienedicarboxylic acid [Term] id: CHEBI:15565 name: (1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:23469 ! cyclohexadienediol [Term] id: CHEBI:15566 name: (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:15567 name: (1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid [Term] id: CHEBI:15568 name: (R)-2-halocarboxylic acid is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:15569 name: N-(carboxyaminomethyl)urea is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:15570 name: D-alanine is_a: CHEBI:16449 ! alanine is_a: CHEBI:16733 ! D-alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77881 ! EC 4.3.1.15 (diaminopropionate ammonia-lyase) inhibitor [Term] id: CHEBI:15571 name: hydrazine subset: chebi_ph7_3 is_a: CHEBI:24631 ! hydrazines is_a: CHEBI:35107 ! azane relationship: has_role CHEBI:77090 ! EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor [Term] id: CHEBI:15572 name: 2,3-dihydroxybenzoyl 5'-adenylate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15573 name: (2-aminoethyl)phosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15574 name: nuatigenin subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:26606 ! sapogenin [Term] id: CHEBI:15575 name: nuatigenin 3-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:15576 name: (24R)-24-methylcycloart-25-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:15577 name: (3beta,24R,24'R)-fucosterol epoxide subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid [Term] id: CHEBI:15578 name: (25S)-5beta-spirostan-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:26606 ! sapogenin [Term] id: CHEBI:15579 name: (25S)-5beta-spirostan-3beta-yl beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:15580 name: (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:15581 name: juvenile hormone II subset: chebi_ph7_3 is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:32955 ! epoxide is_a: CHEBI:4986 ! fatty acid methyl ester is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:15582 name: (2R,3S)-2,3-dimethylmalic acid is_a: CHEBI:15590 ! 2,3-dimethylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid [Term] id: CHEBI:15583 name: (R)-2-ethylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:155830 name: N-acetyl-D-muramoyl-L-alanyl-D-isoglutamine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:155837 name: tripeptide zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:15584 name: citramalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15586 name: D-citramalic acid is_a: CHEBI:15584 ! citramalic acid [Term] id: CHEBI:15587 name: (R)-3,3-dimethylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:15588 name: (R)-malate(2-) subset: chebi_ph7_3 is_a: CHEBI:15595 ! malate(2-) [Term] id: CHEBI:155885 name: alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base(1-) subset: chebi_ph7_3 is_a: CHEBI:155932 ! alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-(R)-4-hydroxysphingoid base(1-) [Term] id: CHEBI:15589 name: (S)-malate(2-) subset: chebi_ph7_3 is_a: CHEBI:15595 ! malate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15590 name: 2,3-dimethylmalic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:155900 name: 4-quinolone subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:155902 name: 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:15591 name: 3-ethylmalic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:15592 name: 3-isopropylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:155926 name: 1D-myo-inositol-1-phospho-N-[(R)-2-hydroxy-very-long-chain fatty acyl]-(R)-4-hydroxysphingoid base(1-) subset: chebi_ph7_3 is_a: CHEBI:144720 ! inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-4R-hydroxysphingoid base(1-) [Term] id: CHEBI:15593 name: 3-oxalomalate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:155932 name: alpha-D-mannosyl-(1<->6)-1D-myo-inositol-1-phospho-N-(2-hydroxy-very-long-chain fatty acyl)-(R)-4-hydroxysphingoid base(1-) subset: chebi_ph7_3 is_a: CHEBI:167046 ! mannosyl-alpha-1->6-inositol-1-phospho-N-(2-hydroxyacyl)-phytoceramide(1-) [Term] id: CHEBI:15594 name: 3-propylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:15595 name: malate(2-) subset: chebi_ph7_3 is_a: CHEBI:25115 ! malate is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15596 name: sinapic acid (S)-malate ester is_a: CHEBI:36188 ! malate ester [Term] id: CHEBI:15597 name: (2R)-2-O-phosphonato-3-sulfonatolactate(4-) subset: chebi_ph7_3 is_a: CHEBI:193092 ! O-phospho-3-sulfolactate(4-) is_a: CHEBI:61693 ! carboxyalkyl phosphate oxoanion [Term] id: CHEBI:15598 name: 2-methylcitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15599 name: cis-3-phenylcyclohexa-3,5-diene-1,2-diol is_a: CHEBI:48949 ! 3-phenylcyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:15600 name: (+)-catechin subset: chebi_ph7_3 is_a: CHEBI:23053 ! catechin relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15601 name: (2R,4S)-2,4-diaminopentanoate is_a: CHEBI:16594 ! 2,4-diaminopentanoate [Term] id: CHEBI:15602 name: (2S)-2-[(R)-1-carboxyethylamino]pentanoate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:15603 name: L-leucine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:25017 ! leucine is_a: CHEBI:26463 ! pyruvate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15604 name: (3R)-beta-leucine is_a: CHEBI:72772 ! beta-leucine [Term] id: CHEBI:15605 name: (2S)-flavan-4-ol subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:15606 name: (2S)-flavanone subset: chebi_ph7_3 is_a: CHEBI:5070 ! flavanone [Term] id: CHEBI:156068 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:15607 name: (2S,3R)-3-hydroxybutane-1,2,3-tricarboxylic acid is_a: CHEBI:142525 ! 3-hydroxybutane-1,2,3-tricarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15608 name: (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:15609 name: N-(aminomethyl)urea is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:15610 name: gibberellin A12 aldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:20859 ! C20-gibberellin [Term] id: CHEBI:15611 name: sarcosine is_a: CHEBI:21760 ! N-methyl-amino acid is_a: CHEBI:21766 ! N-methylglycines is_a: CHEBI:66933 ! N-alkylglycine relationship: has_role CHEBI:64588 ! glycine transporter 1 inhibitor relationship: has_role CHEBI:64589 ! glycine receptor agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15613 name: (3S)-3,6-diaminohexanoic acid is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:35987 ! diamino acid [Term] id: CHEBI:156132 name: L-thialysinium subset: chebi_ph7_3 is_a: CHEBI:47910 ! S-substituted L-cysteine [Term] id: CHEBI:15614 name: (S)-3-methyl-2-oxovaleric acid is_a: CHEBI:35932 ! 3-methyl-2-oxovaleric acid [Term] id: CHEBI:15615 name: (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:15616 name: (3S,5S)-3,5-diaminohexanoic acid is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:35987 ! diamino acid [Term] id: CHEBI:15617 name: (2R,3Z)-phycocyanobilin is_a: CHEBI:47955 ! (2R)-phycocyanobilin [Term] id: CHEBI:15618 name: (3Z)-phycoerythrobilin is_a: CHEBI:36741 ! phycoerythrobilin [Term] id: CHEBI:15619 name: (3Z)-phytochromobilin is_a: CHEBI:26116 ! phytochromobilin [Term] id: CHEBI:15620 name: N-ethylglycine is_a: CHEBI:66933 ! N-alkylglycine [Term] id: CHEBI:15621 name: (4-hydroxyphenyl)acetaldehyde subset: chebi_ph7_3 is_a: CHEBI:25973 ! phenylacetaldehydes is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15622 name: 2,3-diketogulonic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:51869 ! alpha-diketone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15623 name: 3-deoxy-D-glycero-hexo-2,5-diulosonic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:15624 name: (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:15625 name: S-adenosylmethioninamine is_a: CHEBI:22260 ! adenosines is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:156255 name: S-adenosyl-D-methionine is_a: CHEBI:26830 ! sulfonium compound [Term] id: CHEBI:15626 name: 12(S)-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:156262 name: O-(S-octanoylpantetheine-4-phosphoryl)serine residue is_a: CHEBI:76241 ! O-(S-acylpantetheine-4'-phosphoryl)serine residue [Term] id: CHEBI:156263 name: O-(S-decanoylpantetheine-4-phosphoryl)serine residue is_a: CHEBI:76241 ! O-(S-acylpantetheine-4'-phosphoryl)serine residue [Term] id: CHEBI:15627 name: thromboxane A2 is_a: CHEBI:23931 ! epoxy monocarboxylic acid is_a: CHEBI:36088 ! thromboxanes A relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15628 name: 15(S)-HPETE is_a: CHEBI:91271 ! 15-HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15629 name: 8(R)-HPETE is_a: CHEBI:24644 ! HPETE [Term] id: CHEBI:15630 name: (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:15631 name: (5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:156311 name: trininoleoyl-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:65092 ! 1-monolysocardiolipin(2-) [Term] id: CHEBI:15632 name: 5(S)-HPETE is_a: CHEBI:91268 ! 5-HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15633 name: dihydrofolic acid is_a: CHEBI:23743 ! dihydrofolic acids relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15634 name: 10-formyldihydrofolic acid is_a: CHEBI:23743 ! dihydrofolic acids [Term] id: CHEBI:15635 name: (6S)-5,6,7,8-tetrahydrofolic acid is_a: CHEBI:20506 ! 5,6,7,8-tetrahydrofolic acid relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:15636 name: (6R)-5,10-methylenetetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:12071 ! 5,10-methylenetetrahydrofolate(2-) relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15637 name: 10-formyltetrahydrofolic acid is_a: CHEBI:24099 ! formyltetrahydrofolic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:156379 name: paraherquonin subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:37668 ! terpene lactone is_a: CHEBI:38166 ! organic heteropolycyclic compound is_a: CHEBI:64419 ! meroterpenoid [Term] id: CHEBI:15638 name: (6R)-5,10-methenyltetrahydrofolic acid is_a: CHEBI:25297 ! methylenetetrahydrofolic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15639 name: 5-formimidoyltetrahydrofolic acid is_a: CHEBI:24085 ! formimidoyltetrahydrofolic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15640 name: 5-formyltetrahydrofolic acid is_a: CHEBI:24099 ! formyltetrahydrofolic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:156403 name: hydroperoxy fatty amide is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:61051 ! lipid hydroperoxide [Term] id: CHEBI:15641 name: 5-methyltetrahydrofolic acid is_a: CHEBI:26907 ! tetrahydrofolic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15642 name: 4a-hydroxy-L-erythro-5,6,7,8-tetrahydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:15374 ! 4a-hydroxytetrahydrobiopterin [Term] id: CHEBI:15644 name: (S)-NADHX(1+) is_a: CHEBI:26916 ! tetrahydronicotinamide adenine dinucleotide [Term] id: CHEBI:15645 name: (6S)-6-hydroxyhyoscyamine is_a: CHEBI:32876 ! tertiary amine [Term] id: CHEBI:15646 name: 20-hydroxy-leukotriene B4 is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:156460 name: novofumigatonin subset: chebi_ph7_3 is_a: CHEBI:38166 ! organic heteropolycyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:64419 ! meroterpenoid is_a: CHEBI:71989 ! ortho ester [Term] id: CHEBI:156461 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-ribonucleoside(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:15647 name: leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:156473 name: cyclobutanes is_a: CHEBI:33598 ! carbocyclic compound [Term] id: CHEBI:15648 name: (6aR,11aR)-3,9-dihydroxypterocarpan subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans [Term] id: CHEBI:15649 name: 3,6,9-trihydroxypterocarpan subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:15650 name: leukotriene E4 is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:15651 name: leukotriene A4 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15652 name: 5'-xanthylic acid is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:53012 ! xanthosine 5'-phosphate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15653 name: (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:156536 name: oligoglycosyl-(1->4)-D-glucose subset: chebi_ph7_3 is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:156548 name: kainate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:15655 name: 13(S)-HPODE is_a: CHEBI:91272 ! 13-HPODE relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15657 name: (11S)-11-hydroperoxylinoleic acid is_a: CHEBI:78013 ! linoleic acid hydroperoxide [Term] id: CHEBI:15658 name: 7(S),8(S)-DiHODE is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:36326 ! octadecanoid [Term] id: CHEBI:15659 name: (E)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide subset: chebi_ph7_3 is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:22216 ! acrylamides is_a: CHEBI:24129 ! furans is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:15660 name: (Z)-2-(2-furyl)-3-(5-nitro-2-furyl)acrylamide subset: chebi_ph7_3 is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:22216 ! acrylamides is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:87230 ! nitrofuran antibiotic [Term] id: CHEBI:15661 name: (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:4986 ! fatty acid methyl ester [Term] id: CHEBI:15662 name: (2E)-2,6-dimethylocta-2,7-diene-1,6-diol subset: chebi_ph7_3 is_a: CHEBI:25636 ! octadienediol [Term] id: CHEBI:15663 name: (2E)-3-(methoxycarbonyl)pent-2-enedioic acid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:4986 ! fatty acid methyl ester relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15664 name: (2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate is_a: CHEBI:26250 ! prenol phosphate relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59544 ! phosphoantigen relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15665 name: (4-hydroxyphenyl)acetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:24731 ! hydroxyphenylacetaldehyde oxime [Term] id: CHEBI:15666 name: (E)-(4-hydroxyphenyl)acetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:15665 ! (4-hydroxyphenyl)acetaldehyde oxime [Term] id: CHEBI:15667 name: (Z)-(4-hydroxyphenyl)acetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:15665 ! (4-hydroxyphenyl)acetaldehyde oxime [Term] id: CHEBI:15668 name: (1E)-4-oxobut-1-ene-1,2,4-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:15669 name: trans-cinnamate subset: chebi_ph7_3 is_a: CHEBI:23248 ! cinnamate [Term] id: CHEBI:15670 name: (E)-glutaconic acid is_a: CHEBI:24309 ! glutaconic acid [Term] id: CHEBI:15671 name: L-tartaric acid is_a: CHEBI:26849 ! tartaric acid [Term] id: CHEBI:15672 name: D-tartaric acid is_a: CHEBI:26849 ! tartaric acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15673 name: meso-tartaric acid is_a: CHEBI:15674 ! 2,3-dihydroxybutanedioic acid [Term] id: CHEBI:15674 name: 2,3-dihydroxybutanedioic acid is_a: CHEBI:26933 ! tetraric acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:15675 name: (2R)-1-aminopropan-2-ol is_a: CHEBI:19030 ! 1-aminopropan-2-ol [Term] id: CHEBI:15676 name: allantoin subset: chebi_ph7_3 is_a: CHEBI:24628 ! imidazolidine-2,4-dione is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15677 name: (R)-(-)-allantoin subset: chebi_ph7_3 is_a: CHEBI:15676 ! allantoin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15678 name: (S)-(+)-allantoin subset: chebi_ph7_3 is_a: CHEBI:15676 ! allantoin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15679 name: alpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide is_a: CHEBI:36508 ! glycotriaosylceramide [Term] id: CHEBI:15681 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:79209 ! alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide relationship: has_part CHEBI:142767 ! alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-yl group relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15682 name: (N(omega)-L-arginino)succinic acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15683 name: (R)-10-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion is_a: CHEBI:143089 ! 10-hydroxyoctadecanoate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:15684 name: (R)-2,3-dihydroxy-3-methylbutanoic acid is_a: CHEBI:15689 ! 2,3-dihydroxy-3-methylbutanoic acid [Term] id: CHEBI:15685 name: L-2-succinylamino-6-oxoheptanedioate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:15686 name: (R)-acetoin subset: chebi_ph7_3 is_a: CHEBI:15688 ! acetoin relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:15687 name: (S)-acetoin subset: chebi_ph7_3 is_a: CHEBI:15688 ! acetoin [Term] id: CHEBI:15688 name: acetoin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15689 name: 2,3-dihydroxy-3-methylbutanoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:15690 name: 20-hydroxy-3-oxopregn-4-en-21-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:36886 ! 21-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:15692 name: 3'-demethylstaurosporine is_a: CHEBI:37697 ! indolocarbazole alkaloid [Term] id: CHEBI:15693 name: aldose subset: chebi_ph7_3 is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:15694 name: (R)-S-lactoylglutathione is_a: CHEBI:24337 ! glutathione derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15695 name: D-4-hydroxyphenylglycine is_a: CHEBI:50418 ! 4-hydroxyphenylglycine [Term] id: CHEBI:15696 name: beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:15698 name: 2'-deoxycytidine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15699 name: L-homoserine is_a: CHEBI:30653 ! homoserine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15700 name: dTDP-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15702 name: terephthalic acid is_a: CHEBI:26094 ! benzenedicarboxylic acid [Term] id: CHEBI:15703 name: alpha-maltose 6'-phosphate is_a: CHEBI:111006 ! maltose 6'-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15704 name: 6-alkylamino-7-beta-D-glucosylpurine subset: chebi_ph7_3 is_a: CHEBI:17524 ! 6-alkylaminopurine is_a: CHEBI:21731 ! N-glycosyl compound [Term] id: CHEBI:15705 name: L-alpha-amino acid is_a: CHEBI:33704 ! alpha-amino acid [Term] id: CHEBI:15707 name: 2,6-dioxo-6-phenylhexanoic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:15708 name: trans-aconitate(3-) subset: chebi_ph7_3 is_a: CHEBI:22210 ! aconitate(3-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15709 name: xanthotoxol subset: chebi_ph7_3 is_a: CHEBI:52025 ! 8-hydroxyfurocoumarin [Term] id: CHEBI:15710 name: betaine aldehyde subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15711 name: 1D-1-O-(indol-3-yl)acetyl-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:64426 ! cyclitol ester is_a: CHEBI:64633 ! indoleacetic acid ester conjugate [Term] id: CHEBI:15712 name: 2,3-dihydrobiochanin A subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone is_a: CHEBI:72740 ! methoxyisoflavanone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:15713 name: UTP is_a: CHEBI:27232 ! uridine 5'-phosphate is_a: CHEBI:37044 ! pyrimidine ribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15714 name: trans-sinapic acid is_a: CHEBI:77131 ! sinapic acid relationship: has_role CHEBI:64345 ! MALDI matrix material relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15715 name: streptomycin 3''-phosphate is_a: CHEBI:26787 ! streptomycin phosphate [Term] id: CHEBI:15716 name: 12-hydroxydihydrochelirubine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid [Term] id: CHEBI:15717 name: 4beta-(hydroxymethyl)-4alpha-methyl-5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:143566 ! 3beta-hydroxy-4beta-hydroxymethyl-4alpha-methylsteroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:15718 name: 2,3',4,6-tetrahydroxybenzophenone is_a: CHEBI:24677 ! hydroxybenzophenone [Term] id: CHEBI:15720 name: 8-[(1R,2R)-3-oxo-2-\{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:15721 name: sedoheptulose 7-phosphate is_a: CHEBI:35133 ! ketoheptose phosphate is_a: CHEBI:63403 ! sedoheptulose derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15723 name: 1,6-bis-O-galloyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:24183 ! galloyl beta-D-glucose is_a: CHEBI:37576 ! gallate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15724 name: trimethylamine N-oxide subset: chebi_ph7_3 is_a: CHEBI:134363 ! tertiary amine oxide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:25728 ! osmolyte relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15725 name: trimethylenediamine is_a: CHEBI:35411 ! alkane-alpha,omega-diamine relationship: has_role CHEBI:33893 ! reagent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15726 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphocholine is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:15727 name: carnosine is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:15728 name: 4-guanidinobutanoic acid is_a: CHEBI:24436 ! guanidines relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:15729 name: L-ornithine is_a: CHEBI:18257 ! ornithine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15730 name: pyruvic oxime is_a: CHEBI:24983 ! ketoxime [Term] id: CHEBI:15732 name: phosphonoacetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26069 ! phosphonic acids relationship: has_role CHEBI:131699 ! EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor relationship: has_role CHEBI:22587 ! antiviral agent [Term] id: CHEBI:15733 name: N-methylaniline subset: chebi_ph7_3 is_a: CHEBI:25275 ! methylaniline is_a: CHEBI:32863 ! secondary amine is_a: CHEBI:60977 ! phenylalkylamine [Term] id: CHEBI:15734 name: primary alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:15735 name: S-formylmycothiol subset: chebi_ph7_3 is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:15737 name: N-carbamoylsarcosine is_a: CHEBI:24373 ! glycine derivative [Term] id: CHEBI:15738 name: staurosporine is_a: CHEBI:37697 ! indolocarbazole alkaloid is_a: CHEBI:38165 ! organic heterooctacyclic compound relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:37700 ! EC 2.7.11.13 (protein kinase C) inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:15739 name: isopropylamine is_a: CHEBI:17062 ! primary aliphatic amine is_a: CHEBI:22331 ! alkylamines [Term] id: CHEBI:15740 name: formate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15741 name: succinic acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:49201 ! anti-ulcer drug relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15742 name: pseudotropine is_a: CHEBI:37332 ! tropane alkaloid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15743 name: butanal subset: chebi_ph7_3 is_a: CHEBI:22939 ! butanals relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15745 name: 2-aminomuconic 6-semialdehyde is_a: CHEBI:38436 ! muconic semialdehyde is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15746 name: spermine is_a: CHEBI:39166 ! tetramine is_a: CHEBI:39474 ! polyazaalkane relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15748 name: D-glucuronate is_a: CHEBI:24297 ! glucuronate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15749 name: 3-carboxy-cis,cis-muconic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:15750 name: dolichyl diphosphate is_a: CHEBI:23875 ! dolichol phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15751 name: ADP alpha-D-glucoside is_a: CHEBI:17193 ! ADP-aldose is_a: CHEBI:22390 ! alpha-D-glucoside relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15753 name: 2-oxoadipic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:15754 name: 3-O-beta-D-galactopyranosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:137979 ! D-galactosylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15755 name: 3alpha,7alpha,12beta-trihydroxy-5beta-cholanate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15756 name: hexadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77119 ! EC 1.1.1.189 (prostaglandin-E2 9-reductase) inhibitor relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15757 name: (S)-4-amino-5-oxopentanoic acid is_a: CHEBI:24313 ! glutamic semialdehyde is_a: CHEBI:33707 ! gamma-amino acid is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15758 name: leucocyanidin subset: chebi_ph7_3 is_a: CHEBI:60835 ! leucoanthocyanidin [Term] id: CHEBI:15759 name: 2,3-epoxyphylloquinone subset: chebi_ph7_3 is_a: CHEBI:26127 ! phytylnaphthoquinone [Term] id: CHEBI:157597 name: N-tetracosenoyl-sphingoid base subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base [Term] id: CHEBI:15760 name: tyramine is_a: CHEBI:25375 ! monoamine molecular messenger is_a: CHEBI:27175 ! tyramines is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:37733 ! EC 3.1.1.8 (cholinesterase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:157606 name: sphinga-(4E,8Z)-dienine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:15761 name: N-methylpyridinium subset: chebi_ph7_3 is_a: CHEBI:25340 ! methylpyridines [Term] id: CHEBI:157625 name: alpha-D-mannopyranuronate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:15763 name: nicotinic acid D-ribonucleotide is_a: CHEBI:37008 ! nicotinic acid mononucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15764 name: anthocyanidin 3,5-diglucoside is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:15765 name: L-dopa is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:49168 ! dopa is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:35219 ! plant growth retardant relationship: has_role CHEBI:48407 ! antiparkinson drug relationship: has_role CHEBI:48560 ! dopaminergic agent relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:62215 ! allelochemical relationship: has_role CHEBI:66956 ! antidyskinesia agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15766 name: N-benzoyl-D-arginine-4-nitroanilide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:21681 ! N-benzoyl-D-arginines is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:157662 name: N-(omega-linoleoyloxy-ultra-long chain fatty acyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:144785 ! omega-linoleoyloxy-O-ultra-long chain acylceramide is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:157663 name: N-(omega-hydroxy-ultra-long chain fatty acyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:144784 ! omega-hydroxy-ultra-long chain fatty acylceramide is_a: CHEBI:195362 ! N-(omega-hydroxyacyl)-sphingosine is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:157668 name: carbocyclic fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:157669 name: carbocyclic fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:15767 name: dichloromethane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:23148 ! chloromethanes relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:157670 name: alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranosyl-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:157673 name: alpha-D-abequose-(1->3)-alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranosyl-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:15768 name: 3,5-diiodo-L-tyrosine is_a: CHEBI:23796 ! diiodotyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:157685 name: primary linear alkyl sulfate ester(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:15769 name: N-[(R)-4-phosphopantothenoyl]-L-cysteine is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:157692 name: (2S)-2-amino-5-hydroxy-4-oxopentanoate residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:157695 name: 3'-end deoxyribonucleotide 2,3-dehydro-2,3-deoxyribose phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:157698 name: glucohexaose is_a: CHEBI:24268 ! glucooligosaccharide is_a: CHEBI:35368 ! hexasaccharide [Term] id: CHEBI:15770 name: D-erythritol 4-phosphate is_a: CHEBI:22294 ! alditol 4-phosphate is_a: CHEBI:26980 ! tetritol phosphate [Term] id: CHEBI:157706 name: (2E,4S)-4,5-dihydroxypent-2-enal subset: chebi_ph7_3 is_a: CHEBI:61722 ! 2-pentenal [Term] id: CHEBI:15771 name: loganin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:50563 ! iridoid monoterpenoid is_a: CHEBI:51702 ! enoate ester is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor relationship: has_role CHEBI:74925 ! EC 3.4.23.46 (memapsin 2) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15772 name: L-dopachrome is_a: CHEBI:49108 ! dopachrome relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15773 name: cyclohexylamine is_a: CHEBI:17062 ! primary aliphatic amine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:15774 name: dTDP-beta-L-rhamnose is_a: CHEBI:35452 ! dTDP-L-rhamnose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:157740 name: N-(fatty acyl)-dopamine subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:15775 name: 3-oxoadipate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:157750 name: heparan sulfate polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:157757 name: 1,2-diacyl-sn-glycero-3-phospho-(N-acyl)-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:35766 ! glycerophosphoserine [Term] id: CHEBI:157758 name: 1-acyl-2-hydroxy-sn-glycero-3-phospho-(N-acyl)-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:35766 ! glycerophosphoserine [Term] id: CHEBI:157759 name: glycosylmonoacylglycerol subset: chebi_ph7_3 is_a: CHEBI:166903 ! glycosylmonoradylglycerol is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:47778 ! glyceride [Term] id: CHEBI:15776 name: cephalosporin C is_a: CHEBI:23066 ! cephalosporin relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:157763 name: polyprenol phosphate anion subset: chebi_ph7_3 is_a: CHEBI:26244 ! prenols [Term] id: CHEBI:157766 name: 2-hydroxy-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:15777 name: 4-oxocyclohexanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:157770 name: short-chain primary fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:142622 ! primary fatty alcohol [Term] id: CHEBI:157771 name: hydroperoxydocosapentaenoate is_a: CHEBI:131864 ! docosanoid anion is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion [Term] id: CHEBI:157772 name: epoxydocosatetraenoate is_a: CHEBI:131864 ! docosanoid anion [Term] id: CHEBI:157773 name: epoxydocosapentaenoate is_a: CHEBI:131864 ! docosanoid anion [Term] id: CHEBI:157774 name: epoxydocosahexaenoate is_a: CHEBI:131864 ! docosanoid anion [Term] id: CHEBI:157775 name: N-acyl-beta-D-galactosylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:143593 ! beta-galactosylceramide [Term] id: CHEBI:15778 name: N-acyl-D-amino acid is_a: CHEBI:51569 ! N-acyl-amino acid is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:15779 name: N-acyl-D-aspartic acid is_a: CHEBI:15778 ! N-acyl-D-amino acid is_a: CHEBI:21654 ! N-acyl-aspartic acid is_a: CHEBI:83979 ! D-aspartic acid derivative [Term] id: CHEBI:15781 name: N(alpha),N(alpha),N(alpha)-trimethyl-L-histidine subset: chebi_ph7_3 is_a: CHEBI:21911 ! N(alpha)-methyl-L-histidines is_a: CHEBI:22860 ! amino-acid betaine [Term] id: CHEBI:15782 name: viomycin is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic relationship: has_role CHEBI:33231 ! antitubercular agent [Term] id: CHEBI:15783 name: N,N-dimethyl-1,4-phenylenediamine subset: chebi_ph7_3 is_a: CHEBI:23666 ! diamine is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:15784 name: N-acetyl-D-glucosamine 6-phosphate is_a: CHEBI:15993 ! N-acyl-D-glucosamine 6-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15785 name: 1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine is_a: CHEBI:76170 ! olefinic phospholipid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15786 name: 3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine is_a: CHEBI:17311 ! N(6),N(6),N(6)-trimethyl-L-lysine is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15787 name: deoxylimonoic acid D-ring-lactone is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24129 ! furans is_a: CHEBI:25000 ! lactone is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:39434 ! limonoid [Term] id: CHEBI:15788 name: 3,5-dichlorocatechol subset: chebi_ph7_3 is_a: CHEBI:23699 ! dichlorocatechol [Term] id: CHEBI:15789 name: 2'-O-methyllicodione is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:71230 ! dihydrochalcones is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:15791 name: (S)-2-halocarboxylic acid is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:15792 name: malonate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) relationship: has_role CHEBI:25355 ! mitochondrial respiratory-chain inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15793 name: 3-hydroxyanthranilic acid is_a: CHEBI:22495 ! aminobenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15794 name: juglone subset: chebi_ph7_3 is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:70982 ! reactive oxygen species generator [Term] id: CHEBI:15795 name: protoaphin aglucone is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:33853 ! phenols is_a: CHEBI:48129 ! benzoisochromanequinone [Term] id: CHEBI:15799 name: 1-palmitoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:64023 ! 1-palmitoylglycerol 3-phosphate [Term] id: CHEBI:158 name: (-)-neodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite [Term] id: CHEBI:15801 name: (R)-2-hydroxyglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:11596 ! 2-hydroxyglutarate(2-) [Term] id: CHEBI:15802 name: alpha,beta-didehydrotryptophan is_a: CHEBI:145326 ! 2,3-dehydroamino acid [Term] id: CHEBI:15805 name: D-octopine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83229 ! amino acid opine is_a: CHEBI:83966 ! D-arginine derivative relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:15807 name: beta-L-arabinose 1-phosphate is_a: CHEBI:35423 ! L-arabinose 1-phosphate [Term] id: CHEBI:15808 name: 12-dehydrotetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:15809 name: dolichyl D-mannosyl phosphate is_a: CHEBI:23875 ! dolichol phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15811 name: O-phospho-L-serine is_a: CHEBI:37712 ! O-phosphoserine relationship: has_role CHEBI:62089 ! EC 1.4.7.1 [glutamate synthase (ferredoxin)] inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77089 ! EC 2.5.1.49 (O-acetylhomoserine aminocarboxypropyltransferase) inhibitor relationship: has_role CHEBI:77090 ! EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15812 name: dolichyl beta-D-glucosyl phosphate is_a: CHEBI:23875 ! dolichol phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15815 name: quinolin-4-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:15816 name: D-arginine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:29016 ! arginine relationship: has_role CHEBI:65053 ! EC 4.1.1.19 (arginine decarboxylase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15817 name: semiquinone is_a: CHEBI:36872 ! organic radical [Term] id: CHEBI:15819 name: N(6)-(dimethylallyl)adenosine 5'-monophosphate is_a: CHEBI:21865 ! N(6)-dimethylallyladenosine 5'-monophosphate [Term] id: CHEBI:15820 name: GDP-alpha-D-mannose is_a: CHEBI:84880 ! GDP-D-mannose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15821 name: 5-hydroxy-6-methylpyridine-3-carboxylic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:38182 ! monohydroxypyridine [Term] id: CHEBI:15822 name: 17alpha-estradiol 3-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:15824 name: D-fructose is_a: CHEBI:28757 ! fructose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:15825 name: 3-methylbut-2-enal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15826 name: 16alpha-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid [Term] id: CHEBI:15827 name: N(omega)-(ADP-D-ribosyl)-L-arginine is_a: CHEBI:83965 ! L-arginine derivative relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor [Term] id: CHEBI:15829 name: L-serine O-sulfate is_a: CHEBI:37862 ! O-sulfoamino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:15830 name: 8-amino-7-oxononanoic acid is_a: CHEBI:33709 ! amino acid is_a: CHEBI:35983 ! 7-oxo monocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:15831 name: geranylgeranyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:15832 name: urea-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:15833 name: sulcatol subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:26013 ! pheromone [Term] id: CHEBI:15834 name: 1-O-galloyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:24183 ! galloyl beta-D-glucose is_a: CHEBI:37576 ! gallate ester [Term] id: CHEBI:15835 name: 1-acylglycerone 3-phosphate is_a: CHEBI:22231 ! acylglycerone phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15836 name: 4-phospho-L-aspartic acid is_a: CHEBI:36951 ! aminoacyl phosphate is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83978 ! L-aspartic acid derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15837 name: isoamylol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:50584 ! alkyl alcohol relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:15838 name: (7R)-7-(5-carboxy-5-oxopentanamido)cephalosporanic acid is_a: CHEBI:23066 ! cephalosporin [Term] id: CHEBI:15840 name: N-acylneuraminic acid 9-phosphate is_a: CHEBI:21662 ! N-acylneuraminic acid phosphate [Term] id: CHEBI:15841 name: polypeptide is_a: CHEBI:16670 ! peptide is_a: CHEBI:33839 ! macromolecule [Term] id: CHEBI:15842 name: orotidine 5'-phosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15843 name: arachidonic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:36306 ! icosa-5,8,11,14-tetraenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite [Term] id: CHEBI:15844 name: 1D-myo-inositol 3,4,5,6-tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15845 name: keto-L-tagatose 6-phosphate is_a: CHEBI:13173 ! L-tagatose 6-phosphate [Term] id: CHEBI:15846 name: NAD(+) is_a: CHEBI:13389 ! NAD is_a: CHEBI:13390 ! NAD(P)(+) relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15847 name: 2-(alpha-D-mannosyl)-D-glyceric acid is_a: CHEBI:60940 ! D-mannosyl-D-glyceric acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15848 name: dTDP-galactose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:15849 name: aryl(methyl)malonic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:15850 name: 1-O-alkyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol is_a: CHEBI:76575 ! monoradylglycerol is_a: CHEBI:77997 ! 1(3)-O-alkylglycerol [Term] id: CHEBI:15851 name: 3-(uracil-1-yl)-L-alanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:15852 name: aquacob(III)alamin subset: chebi_ph7_3 is_a: CHEBI:140785 ! R-cob(III)alamin is_a: CHEBI:23333 ! cob(III)alamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15854 name: quinine is_a: CHEBI:51323 ! cinchona alkaloid relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:51371 ! muscle relaxant [Term] id: CHEBI:15855 name: UDP-6-sulfoquinovose is_a: CHEBI:17297 ! UDP-sugar is_a: CHEBI:38029 ! carbohydrate sulfonate [Term] id: CHEBI:15857 name: 5-L-glutamyl amino acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:15858 name: bromide subset: chebi_ph7_3 is_a: CHEBI:16042 ! halide anion is_a: CHEBI:36896 ! monoatomic bromine [Term] id: CHEBI:15859 name: N-carbamoyl-L-aspartic acid is_a: CHEBI:21686 ! N-carbamoyl-L-amino acid is_a: CHEBI:64850 ! N-carbamoylaspartic acid is_a: CHEBI:83978 ! L-aspartic acid derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:15860 name: N-methylhexanamide subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:15861 name: trichodiene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:15862 name: ethylamine is_a: CHEBI:17062 ! primary aliphatic amine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15864 name: luteolin is_a: CHEBI:27741 ! 3'-hydroxyflavonoid is_a: CHEBI:38684 ! tetrahydroxyflavone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:65207 ! vascular endothelial growth factor receptor antagonist relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:71476 ! EC 2.3.1.85 (fatty acid synthase) inhibitor relationship: has_role CHEBI:76595 ! nephroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:90172 ! c-Jun N-terminal kinase inhibitor [Term] id: CHEBI:15865 name: 6-phospho-2-dehydro-D-gluconate(1-) is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:15866 name: 2-deoxy-D-glucose is_a: CHEBI:23623 ! deoxyglucose relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:15867 name: D-xylono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:27347 ! xylonolactone [Term] id: CHEBI:15868 name: CDP-N-methylethanolamine is_a: CHEBI:25604 ! nucleotide-(amino alcohol)s is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:15870 name: betaine aldehyde hydrate subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion is_a: CHEBI:63733 ! aldehyde hydrate [Term] id: CHEBI:15871 name: o-orsellinate depside is_a: CHEBI:36054 ! benzoate ester [Term] id: CHEBI:15873 name: alpha-D-glucosamine 6-phosphate is_a: CHEBI:47987 ! 2-amino-2-deoxy-D-glucopyranose 6-phosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15874 name: N(2)-malonyl-D-tryptophan is_a: CHEBI:47997 ! D-tryptophan derivative [Term] id: CHEBI:15877 name: L-lupinate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:15878 name: 10-hydroxydihydrosanguinarine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid [Term] id: CHEBI:15880 name: S-methyl 3-phospho-1-thio-D-glycerate is_a: CHEBI:37696 ! carbohydrate acid ester is_a: CHEBI:37702 ! aldonate ester phosphate is_a: CHEBI:51277 ! thioester [Term] id: CHEBI:15881 name: 2-oxopropyl-CoM is_a: CHEBI:23356 ! S-substituted coenzyme M [Term] id: CHEBI:15882 name: phenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:15883 name: P(1),P(4)-bis(5'-guanosyl) tetraphosphate is_a: CHEBI:37067 ! purine ribonucleoside 5'-tetraphosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15884 name: tropine is_a: CHEBI:37332 ! tropane alkaloid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15885 name: L-2-amino-4-chloropent-4-enoic acid is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:15886 name: UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate is_a: CHEBI:33903 ! glucuronates is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:15887 name: 5-aminopentanoic acid is_a: CHEBI:35931 ! delta-amino acid is_a: CHEBI:59758 ! omega-amino fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15888 name: 5-oxohexanoic acid is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:15889 name: sterol subset: chebi_ph7_3 is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:15890 name: 5,6-dimethylbenzimidazole subset: chebi_ph7_3 is_a: CHEBI:23809 ! dimethylbenzimidazole relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15891 name: taurine is_a: CHEBI:37793 ! amino sulfonic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33284 ! nutrient relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:64589 ! glycine receptor agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15892 name: S-succinylglutathione is_a: CHEBI:18126 ! S-acylglutathione [Term] id: CHEBI:15893 name: 1-pyrroline-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26457 ! 1-pyrrolinecarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15894 name: (2-trans,6-trans)-farnesal subset: chebi_ph7_3 is_a: CHEBI:137934 ! polyprenal is_a: CHEBI:24012 ! farnesal [Term] id: CHEBI:15895 name: D-galactono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:24150 ! galactonolactone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15896 name: 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione subset: chebi_ph7_3 is_a: CHEBI:26616 ! seco-androstane [Term] id: CHEBI:15897 name: N-(long-chain-acyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:167098 ! N-(fatty acyl)-ethanolamine [Term] id: CHEBI:15899 name: (R)-5-diphosphomevalonic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15900 name: trans-2,3-epoxysuccinic acid is_a: CHEBI:32955 ! epoxide is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:15901 name: 5,6-dihydrouracil subset: chebi_ph7_3 is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15902 name: alpha-D-xylose 1-phosphate is_a: CHEBI:27349 ! xylose phosphate [Term] id: CHEBI:15903 name: beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:4167 ! D-glucopyranose relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15904 name: long-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:15905 name: (R)-4'-phosphopantothenic acid is_a: CHEBI:37481 ! amidoalkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15906 name: demethylmacrocin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25022 ! leucomycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:15907 name: phosphoramidic acid is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:15908 name: L-threonic acid is_a: CHEBI:26984 ! threonic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15911 name: desulfoglucotropeolin subset: chebi_ph7_3 is_a: CHEBI:136442 ! desulfoglucosinolic acid [Term] id: CHEBI:15913 name: (R)-2-hydroxyoctadecanoic acid is_a: CHEBI:19660 ! 2-hydroxyoctadecanoic acid [Term] id: CHEBI:15914 name: 2-amino-4-oxopentanoic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:15915 name: ADP-L-glycero-D-manno-heptose is_a: CHEBI:20847 ! ADP-glycero-D-manno-heptose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15916 name: serine phosphoethanolamine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:36711 ! phosphoethanolamine is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:15917 name: N-(D-glucopyranosyl)nicotinate subset: chebi_ph7_3 is_a: CHEBI:25533 ! N-glycosylnicotinate [Term] id: CHEBI:15918 name: 2'-deoxycytosine 5'-monophosphate is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15919 name: N(6)-(1,2-dicarboxyethyl)-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15920 name: columbamine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:15925 name: 2-dehydro-3-deoxy-6-phospho-D-gluconic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15926 name: dolichyl diphosphooligosaccharide is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:15927 name: N-ribosylnicotinamide subset: chebi_ph7_3 is_a: CHEBI:25526 ! N-glycosylnicotinamide is_a: CHEBI:47896 ! pyridine nucleoside relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15929 name: (-)-methyl jasmonate subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:52464 ! jasmonate ester relationship: has_role CHEBI:24937 ! jasmonates relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15930 name: atrazine subset: chebi_ph7_3 is_a: CHEBI:38168 ! chloro-1,3,5-triazine is_a: CHEBI:38170 ! diamino-1,3,5-triazine relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:15931 name: 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-4-O-sulfo-D-galactopyranose is_a: CHEBI:20361 ! (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfate [Term] id: CHEBI:15932 name: apiin is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38686 ! dihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone relationship: has_role CHEBI:52425 ! EC 3.2.1.18 (exo-alpha-sialidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15933 name: UDP-D-apiose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:15934 name: 5-amino-6-(D-ribitylamino)uracil subset: chebi_ph7_3 is_a: CHEBI:22532 ! aminouracil is_a: CHEBI:38340 ! hydroxypyrimidine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15935 name: N-acetyl-D-glucosaminylphosphatidylinositol is_a: CHEBI:52572 ! acylglucosaminylphosphatidylinositol [Term] id: CHEBI:15936 name: aldehydo-D-xylose subset: chebi_ph7_3 is_a: CHEBI:65327 ! D-xylose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15937 name: trans-5-O-(4-coumaroyl)-D-quinic acid is_a: CHEBI:26493 ! quinic acid [Term] id: CHEBI:15938 name: pregnan-21-ol subset: chebi_ph7_3 is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:15939 name: glycyrrhizinic acid is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:61778 ! triterpenoid saponin relationship: has_role CHEBI:65232 ! EC 3.4.21.5 (thrombin) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15940 name: nicotinic acid is_a: CHEBI:176839 ! vitamin B3 is_a: CHEBI:26416 ! pyridine alkaloid is_a: CHEBI:26420 ! pyridinemonocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:50247 ! antidote relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:84264 ! EC 3.5.1.19 (nicotinamidase) inhibitor [Term] id: CHEBI:15941 name: 2,3-dihydroxy-2,3-dihydrobenzoic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:15942 name: 2-aminobenzenesulfonate subset: chebi_ph7_3 is_a: CHEBI:22493 ! aminobenzenesulfonate [Term] id: CHEBI:15943 name: poly(glycerol phosphate) macromolecule is_a: CHEBI:26707 ! glycerol phosphate is_a: CHEBI:37997 ! homopolymer macromolecule relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:15944 name: 6-O-methylnorlaudanosoline is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:15945 name: D-galactono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:24150 ! galactonolactone is_a: CHEBI:74105 ! aldono-1,5-lactone [Term] id: CHEBI:15946 name: keto-D-fructose 6-phosphate is_a: CHEBI:78697 ! D-fructose 6-phosphate [Term] id: CHEBI:15947 name: N-acetyl-beta-D-glucosaminylamine subset: chebi_ph7_3 is_a: CHEBI:24273 ! glucosaminylamine [Term] id: CHEBI:15948 name: lycopene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene relationship: has_part CHEBI:139114 ! carotenoid psi-end derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15949 name: diphthamide is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:15950 name: (S)-coclaurine is_a: CHEBI:23347 ! coclaurine [Term] id: CHEBI:15951 name: 3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one subset: chebi_ph7_3 is_a: CHEBI:134316 ! 2-acylphloroglucinol [Term] id: CHEBI:15952 name: dTDP-4-amino-4,6-dideoxy-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:15953 name: 6-imino-5-oxocyclohexa-1,3-dienecarboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:15954 name: aldehydo-D-glucose 6-phosphate is_a: CHEBI:14314 ! D-glucose 6-phosphate [Term] id: CHEBI:15955 name: discadenine is_a: CHEBI:38643 ! 6-isopentenylaminopurine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:15956 name: biotin is_a: CHEBI:176841 ! vitamin B7 is_a: CHEBI:51570 ! biotins relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:15957 name: stipitatic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:15958 name: phosphatidyl-N-methylethanolamine is_a: CHEBI:16038 ! phosphatidylethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15960 name: O-acetylcarnitinium is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:15961 name: O-phospho-L-homoserine is_a: CHEBI:21969 ! O-phosphorylhomoserine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15963 name: ribitol subset: chebi_ph7_3 is_a: CHEBI:25899 ! pentitol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:15964 name: cyclohexylsulfamic acid is_a: CHEBI:35719 ! sulfamic acids relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:15965 name: D-hexose phosphate is_a: CHEBI:47878 ! hexose phosphate [Term] id: CHEBI:15966 name: D-glutamic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:18237 ! glutamic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15968 name: 3-guanidinopropanoic acid is_a: CHEBI:24436 ! guanidines relationship: has_role CHEBI:35526 ! hypoglycemic agent [Term] id: CHEBI:15970 name: O-carbamoyl-L-serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:15971 name: L-histidine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:27570 ! histidine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:15972 name: dTDP-4-amino-4,6-dideoxy-D-galactose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:15975 name: 1D-5-O-methyl-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:25270 ! methyl myo-inositols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15976 name: 3-indoleglycolaldehyde subset: chebi_ph7_3 is_a: CHEBI:24387 ! glycolaldehydes [Term] id: CHEBI:15977 name: cyclohex-2-enone subset: chebi_ph7_3 is_a: CHEBI:48951 ! cyclohexenone [Term] id: CHEBI:15978 name: sn-glycerol 3-phosphate is_a: CHEBI:14336 ! glycerol 1-phosphate is_a: CHEBI:26706 ! sn-glycerol 3-phosphates relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15979 name: 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:15980 name: (R)-pantoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:15981 name: heparan sulfate alpha-D-glucosaminide 3-sulfate is_a: CHEBI:24495 ! heparan alpha-D-glucosaminide is_a: CHEBI:35721 ! heparan sulfates relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15982 name: cob(I)alamin is_a: CHEBI:30411 ! cobalamin relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:15984 name: N-(4-nitrophenyl)-3-oxovalidamine subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:27136 ! triol is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:15986 name: polynucleotide is_a: CHEBI:33695 ! information biomacromolecule is_a: CHEBI:61120 ! nucleobase-containing molecular entity relationship: has_part CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:15987 name: trithionate(2-) subset: chebi_ph7_3 is_a: CHEBI:33482 ! sulfur oxoanion is_a: CHEBI:48154 ! sulfur oxide [Term] id: CHEBI:15989 name: L-methionine S-oxide residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:15992 name: 1-hydroxy-2-naphthoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:15993 name: N-acyl-D-glucosamine 6-phosphate is_a: CHEBI:21637 ! N-acyl-D-glucosamine phosphate [Term] id: CHEBI:15994 name: 5alpha-androstane-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:22542 ! androstane-3,17-dione relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:15996 name: GTP is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate relationship: has_role CHEBI:145437 ! uncoupling protein inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:15997 name: 2-methylpropanamine is_a: CHEBI:22331 ! alkylamines relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:15998 name: (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl trihydrogen diphosphate is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin relationship: has_part CHEBI:68836 ! diphosphate group [Term] id: CHEBI:15999 name: 4-hydroxyphenylpyruvic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:160 name: D-erythro-isocitric acid is_a: CHEBI:30887 ! isocitric acid [Term] id: CHEBI:16000 name: ethanolamine is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23981 ! ethanolamines is_a: CHEBI:32877 ! primary amine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16001 name: 3-phospho-D-glyceroyl dihydrogen phosphate is_a: CHEBI:16826 ! acyl monophosphate is_a: CHEBI:28907 ! 2,3-bisphosphoglyceric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16002 name: D-glucaric acid is_a: CHEBI:17301 ! glucaric acid relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:16003 name: (R)-3-(4-hydroxyphenyl)lactic acid is_a: CHEBI:17385 ! 3-(4-hydroxyphenyl)lactic acid [Term] id: CHEBI:16004 name: (R)-lactate subset: chebi_ph7_3 is_a: CHEBI:24996 ! lactate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16005 name: methylarsonate(2-) is_a: CHEBI:50956 ! organoarsonic acid anion [Term] id: CHEBI:16007 name: methanethiol subset: chebi_ph7_3 is_a: CHEBI:47908 ! alkanethiol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16008 name: salicylaldehyde subset: chebi_ph7_3 is_a: CHEBI:24673 ! hydroxybenzaldehyde relationship: has_role CHEBI:25491 ! nematicide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16009 name: 9-riburonosyladenine is_a: CHEBI:26394 ! purine nucleoside [Term] id: CHEBI:16010 name: 5-oxoproline is_a: CHEBI:25801 ! oxoproline is_a: CHEBI:46701 ! pyrrolidinemonocarboxylic acid is_a: CHEBI:74223 ! pyrrolidin-2-ones relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16011 name: 2-ethylhexan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16013 name: 5-(3,4-diacetoxybut-1-ynyl)-2,2'-bithiophene subset: chebi_ph7_3 is_a: CHEBI:19281 ! 2,2'-bithiophenes is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:16015 name: L-glutamic acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:18237 ! glutamic acid is_a: CHEBI:24318 ! glutamine family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:173085 ! ferroptosis inducer relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16016 name: dihydroxyacetone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:24982 ! ketotriose relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16017 name: benzyl thiocyanate subset: chebi_ph7_3 is_a: CHEBI:26955 ! thiocyanates [Term] id: CHEBI:16018 name: acyl-[acyl-carrier protein] is_a: CHEBI:13534 ! acyl-carrier protein [Term] id: CHEBI:16019 name: prenol subset: chebi_ph7_3 is_a: CHEBI:26244 ! prenols is_a: CHEBI:50582 ! alkenyl alcohol [Term] id: CHEBI:16020 name: 1-methyladenosine subset: chebi_ph7_3 is_a: CHEBI:25273 ! methyladenosine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16021 name: oleandomycin 2'-O-phosphate is_a: CHEBI:36974 ! aminoglycoside phosphate [Term] id: CHEBI:16022 name: CDP-ribitol is_a: CHEBI:35240 ! nucleotide-alditol [Term] id: CHEBI:16023 name: D-erythrulose subset: chebi_ph7_3 is_a: CHEBI:23958 ! erythrulose [Term] id: CHEBI:16024 name: D-mannose is_a: CHEBI:17608 ! D-aldohexose is_a: CHEBI:37684 ! mannose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16026 name: LL-2,6-diaminopimelic acid is_a: CHEBI:23673 ! 2,6-diaminopimelic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16027 name: adenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:63332 ! EC 3.1.3.1 (alkaline phosphatase) inhibitor relationship: has_role CHEBI:65056 ! EC 3.1.3.11 (fructose-bisphosphatase) inhibitor relationship: has_role CHEBI:65057 ! adenosine A1 receptor agonist relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16028 name: L-2,4-diaminobutyrate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:16029 name: N(alpha),N(alpha)-dimethyl-L-histidine is_a: CHEBI:21911 ! N(alpha)-methyl-L-histidines relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:16030 name: acyldolichol subset: chebi_ph7_3 is_a: CHEBI:35701 ! ester [Term] id: CHEBI:16031 name: indole-3-acetamide subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:83628 ! N-acylammonia relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16032 name: androsterone subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:16034 name: phosphoguanidinoacetic acid is_a: CHEBI:17102 ! phosphoramide is_a: CHEBI:24439 ! guanidinoacetic acids [Term] id: CHEBI:16035 name: 2'-hydroxy-2,3-dihydrodaidzein subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone [Term] id: CHEBI:16036 name: ethyl (S)-3-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:23997 ! ethyl 3-hydroxyhexanoate [Term] id: CHEBI:16037 name: 2-nitropropane subset: chebi_ph7_3 is_a: CHEBI:139218 ! secondary nitroalkane relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50908 ! hepatotoxic agent [Term] id: CHEBI:16038 name: phosphatidylethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:16039 name: ITP is_a: CHEBI:24843 ! inosine phosphate is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16040 name: cytosine subset: chebi_ph7_3 is_a: CHEBI:26432 ! pyrimidine nucleobase is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16042 name: halide anion subset: chebi_ph7_3 is_a: CHEBI:33429 ! monoatomic monoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:16044 name: L-methionine residue subset: chebi_ph7_3 is_a: CHEBI:32648 ! methionine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:16046 name: alpha-D-galactosyl undecaprenyl diphosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:16047 name: Lys-tRNA(Lys) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16048 name: FMNH2 is_a: CHEBI:24041 ! flavin mononucleotide relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16049 name: CDP-abequose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:16050 name: N-acetylisatin subset: chebi_ph7_3 is_a: CHEBI:24793 ! indoledione [Term] id: CHEBI:16051 name: poly(ribitol phosphate) is_a: CHEBI:26172 ! poly(ribitol phosphate)s [Term] id: CHEBI:16052 name: propene subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:16053 name: 1beta,3beta,4alpha-p-menthane-3,8-diol subset: chebi_ph7_3 is_a: CHEBI:48249 ! 1r,3c,4t-p-menthane-3,8-diol [Term] id: CHEBI:16054 name: 2-benzylsuccinic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16055 name: aldehydo-L-rhamnose subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:62345 ! L-rhamnose [Term] id: CHEBI:16057 name: prenyl diphosphate is_a: CHEBI:26250 ! prenol phosphate relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59544 ! phosphoantigen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16058 name: 2D-5-O-methyl-2,3,5/4,6-pentahydroxycyclohexanone subset: chebi_ph7_3 is_a: CHEBI:25881 ! pentahydroxycyclohexanone [Term] id: CHEBI:16060 name: 10-deoxysarpagine subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:16062 name: N-acyl-D-mannosamine subset: chebi_ph7_3 is_a: CHEBI:21656 ! N-acyl-hexosamine is_a: CHEBI:25166 ! mannosamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16063 name: limonin 17-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:16064 name: keto-3-deoxy-D-manno-octulosonate subset: chebi_ph7_3 is_a: CHEBI:24961 ! ketoaldonate [Term] id: CHEBI:16065 name: scopolin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23403 ! coumarins is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16066 name: 11-cis-retinal subset: chebi_ph7_3 is_a: CHEBI:15035 ! retinal relationship: has_role CHEBI:23240 ! chromophore relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16067 name: 1D-myo-inositol 1,4,5,6-tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16068 name: 2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:36054 ! benzoate ester [Term] id: CHEBI:16069 name: 1H-imidazole subset: chebi_ph7_3 is_a: CHEBI:14434 ! imidazole [Term] id: CHEBI:16070 name: 1,5-anhydro-D-glucitol subset: chebi_ph7_3 is_a: CHEBI:22558 ! anhydro sugar relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16072 name: maleimide subset: chebi_ph7_3 is_a: CHEBI:35356 ! dicarboximide is_a: CHEBI:55417 ! maleimides relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor [Term] id: CHEBI:16073 name: N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:16074 name: 5beta-cholestan-3-one subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:167166 ! 3-oxocholestane relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16076 name: 11alpha-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:19129 ! 11alpha-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:16077 name: D-glucopyranose 1-phosphate is_a: CHEBI:21006 ! D-glucose monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16079 name: benzyl 2-methyl-3-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:51849 ! beta-ketoester is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:90628 ! benzyl ester [Term] id: CHEBI:16080 name: gamma-amino-beta-hydroxybutyric acid is_a: CHEBI:33707 ! gamma-amino acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:16081 name: dTDP-L-dihydrostreptose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:16082 name: UDP-alpha-D-xylose is_a: CHEBI:17297 ! UDP-sugar relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16083 name: (S)-3-(indol-3-yl)-2-oxobutyric acid is_a: CHEBI:28549 ! 3-(indol-3-yl)-2-oxobutyric acid [Term] id: CHEBI:16084 name: beta-D-fructofuranose 6-phosphate is_a: CHEBI:61553 ! D-fructofuranose 6-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16085 name: UDP-alpha-D-galacturonic acid is_a: CHEBI:13488 ! UDP-D-galacturonic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16086 name: mycothione subset: chebi_ph7_3 is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:16087 name: isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16089 name: 6-deoxyerythronolide B subset: chebi_ph7_3 is_a: CHEBI:23955 ! erythronolide [Term] id: CHEBI:16091 name: dolichol subset: chebi_ph7_3 is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:26199 ! polyprenol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16092 name: isoquinoline subset: chebi_ph7_3 is_a: CHEBI:24922 ! isoquinolines is_a: CHEBI:35570 ! mancude organic heterobicyclic parent is_a: CHEBI:50893 ! azaarene is_a: CHEBI:52362 ! ortho-fused heteroarene [Term] id: CHEBI:16093 name: 2-methylene-3-methylsuccinic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:16094 name: thiosulfate(2-) is_a: CHEBI:33482 ! sulfur oxoanion is_a: CHEBI:48154 ! sulfur oxide is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16095 name: sepiapterin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:16096 name: palmatine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16097 name: GDP-6-deoxy-alpha-D-talose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:16098 name: 4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde is_a: CHEBI:18634 ! (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde [Term] id: CHEBI:16099 name: 4'-O-beta-D-glucosyl-cis-p-coumaric acid is_a: CHEBI:17335 ! 4-O-beta-D-glucosyl-4-coumaric acid [Term] id: CHEBI:16100 name: 1,6-dihydroxy-2-methylcyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid [Term] id: CHEBI:16101 name: ethylbenzene subset: chebi_ph7_3 is_a: CHEBI:38976 ! alkylbenzene [Term] id: CHEBI:16104 name: 3-(2-hydroxyphenyl)propanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16106 name: 2,4-dichloro-5-oxo-2,5-dihydro-2-furylacetic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:16108 name: dihydroxyacetone phosphate is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:24356 ! glycerone phosphates relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16109 name: propane-1,3-diol subset: chebi_ph7_3 is_a: CHEBI:26287 ! propane-1,3-diols relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:16110 name: 1,2-diacyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:49183 ! phosphatidylcholine(1+) relationship: has_role CHEBI:23888 ! drug relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16111 name: nonane-4,6-dione subset: chebi_ph7_3 is_a: CHEBI:25579 ! nonanone is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:16112 name: chlorogenic acid is_a: CHEBI:26848 ! tannin is_a: CHEBI:36087 ! cinnamate ester relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:16113 name: cholesterol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16114 name: medicarpin subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:16116 name: 3-hydroxy-4-methylanthranilic acid is_a: CHEBI:22495 ! aminobenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16118 name: berberine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:86322 ! alkaloid antibiotic is_a: CHEBI:86494 ! botanical anti-fungal agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35608 ! EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:37733 ! EC 3.1.1.8 (cholinesterase) inhibitor relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:48550 ! EC 1.1.1.21 (aldehyde reductase) inhibitor relationship: has_role CHEBI:50469 ! EC 3.1.1.4 (phospholipase A2) inhibitor relationship: has_role CHEBI:50509 ! potassium channel blocker relationship: has_role CHEBI:68612 ! EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor relationship: has_role CHEBI:72854 ! EC 1.13.11.52 (indoleamine 2,3-dioxygenase) inhibitor relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor relationship: has_role CHEBI:77108 ! EC 1.1.1.141 [15-hydroxyprostaglandin dehydrogenase (NAD(+))] inhibitor relationship: has_role CHEBI:77110 ! EC 1.21.3.3 (reticuline oxidase) inhibitor relationship: has_role CHEBI:77111 ! EC 2.1.1.116 [3'-hydroxy-N-methyl-(S)-coclaurine 4'-O-methyltransferase] inhibitor relationship: has_role CHEBI:77113 ! EC 2.7.11.10 (IkappaB kinase) inhibitor relationship: has_role CHEBI:77115 ! EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor [Term] id: CHEBI:16119 name: shikimic acid is_a: CHEBI:23483 ! cyclohexenecarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16120 name: 5-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:25798 ! oxopentanoates is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:71944 ! aldehydic acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:16121 name: N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide is_a: CHEBI:36541 ! sialotriaosylceramide [Term] id: CHEBI:16122 name: 3-(4-hydroxy-3,5-diiodophenyl)lactic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:37142 ! organoiodine compound is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:16123 name: 6-oxocineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole [Term] id: CHEBI:16124 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl group subset: chebi_ph7_3 is_a: CHEBI:24164 ! galactosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:16125 name: hexadecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:197387 ! hexadecanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16126 name: 3-(4-deoxy-beta-D-gluc-4-enosyluronic acid)-N-acetyl-D-glucosamine is_a: CHEBI:132805 ! beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16128 name: dTDP-4-dehydro-6-deoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16130 name: DDT subset: chebi_ph7_3 is_a: CHEBI:23154 ! chlorophenylethane is_a: CHEBI:25705 ! organochlorine insecticide is_a: CHEBI:33836 ! benzenoid aromatic compound is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:138015 ! endocrine disruptor relationship: has_role CHEBI:39412 ! bridged diphenyl acaricide relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:16132 name: 2-deoxy-D-ribose 5-phosphate is_a: CHEBI:19565 ! 2-deoxyribose 5-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16133 name: cyclopentanol subset: chebi_ph7_3 is_a: CHEBI:23495 ! cyclopentanols [Term] id: CHEBI:16134 name: ammonia is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:35107 ! azane is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:59740 ! nucleophilic reagent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:16135 name: isobutyric acid is_a: CHEBI:140601 ! fatty acid 4:0 is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16136 name: hydrogen sulfide is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:33405 ! hydracid is_a: CHEBI:33535 ! sulfur hydride is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16137 name: chondroitin D-glucuronate is_a: CHEBI:37395 ! mucopolysaccharide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16138 name: 2-deoxy-D-gluconic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:16141 name: undecaprenyl dihydrogen phosphate is_a: CHEBI:27193 ! undecaprenyl phosphate [Term] id: CHEBI:16142 name: 3-dehydro-L-gulonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16143 name: 1-guanidino-1-deoxy-scyllo-inositol 4-phosphate is_a: CHEBI:26613 ! scyllo-inositol phosphate [Term] id: CHEBI:16144 name: selenophosphate subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79387 ! trivalent inorganic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16145 name: 3,5/4-trihydroxycyclohexane-1,2-dione is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:16146 name: maleamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:16147 name: 11-O-demethyl-17-O-deacetylvindoline is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27288 ! vinca alkaloid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:16148 name: heptadecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16150 name: benzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16151 name: 3,4-dihydrocoumarin subset: chebi_ph7_3 is_a: CHEBI:38763 ! chromanone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16152 name: 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate is_a: CHEBI:37328 ! phosphatidylinositol bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16153 name: N-acetyllactosamine subset: chebi_ph7_3 is_a: CHEBI:60152 ! beta-D-Galp-(1->4)-D-GlcpNAc [Term] id: CHEBI:16154 name: L-gulonic acid is_a: CHEBI:24462 ! gulonic acid [Term] id: CHEBI:16155 name: myo-inositol 1,3,4,6-tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16157 name: D-arabinonate subset: chebi_ph7_3 is_a: CHEBI:22595 ! arabinonate [Term] id: CHEBI:16158 name: steroid sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester is_a: CHEBI:47880 ! steroid ester [Term] id: CHEBI:16159 name: sulochrin is_a: CHEBI:22726 ! benzophenones is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16160 name: O-succinyl-L-homoserine is_a: CHEBI:138979 ! hemisuccinate is_a: CHEBI:21976 ! o-succinylhomoserine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16161 name: CoA-disulfide is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:16162 name: o-orsellinate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:16163 name: S-carboxymethyl-L-cysteine is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:77034 ! mucolytic [Term] id: CHEBI:16164 name: pyrogallol subset: chebi_ph7_3 is_a: CHEBI:139520 ! phenolic donor is_a: CHEBI:22707 ! benzenetriol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16165 name: D-glucono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:24267 ! gluconolactone [Term] id: CHEBI:16166 name: 2-caffeoylisocitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:16168 name: 6-hydroxynicotinic acid is_a: CHEBI:38182 ! monohydroxypyridine relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:16169 name: homogentisate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:1617 name: 4-hydroxy-3-octaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:78396 ! 4-hydroxy-3-polyprenylbenzoate [Term] id: CHEBI:16170 name: mercury(0) subset: chebi_ph7_3 is_a: CHEBI:35113 ! elemental mercury relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:16171 name: NMN zwitterion is_a: CHEBI:50383 ! nicotinamide mononucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16172 name: neryl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:16173 name: aldehydo-N-acyl-D-mannosamine 6-phosphate is_a: CHEBI:62170 ! N-acyl-D-mannosamine phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16174 name: dADP is_a: CHEBI:19237 ! 2'-deoxyadenosine 5'-phosphate is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16175 name: cholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16176 name: D-ornithine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:18257 ! ornithine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16177 name: vicianose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:16179 name: retinyl ester subset: chebi_ph7_3 is_a: CHEBI:26537 ! retinoid is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:16180 name: N-acylglycine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:16181 name: 1-amino-1-deoxy-scyllo-inositol is_a: CHEBI:61689 ! amino cyclitol [Term] id: CHEBI:16182 name: 2-methylbutanal subset: chebi_ph7_3 is_a: CHEBI:25282 ! methylbutanal is_a: CHEBI:49188 ! 2-methyl-branched fatty aldehyde relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16183 name: methane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18310 ! alkane is_a: CHEBI:37176 ! mononuclear parent hydride is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:35230 ! fossil fuel relationship: has_role CHEBI:76413 ! greenhouse gas relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16184 name: 7-O-acetylsalutaridinol is_a: CHEBI:25418 ! morphinane alkaloid [Term] id: CHEBI:16185 name: N(5)-acyl-L-ornithine ester is_a: CHEBI:46874 ! alpha-amino acid ester [Term] id: CHEBI:16187 name: 1-piperideine-2-carboxylate is_a: CHEBI:36109 ! piperidinecarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16188 name: octan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:37868 ! octanol relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:62803 ! fuel additive relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:83074 ! kairomone [Term] id: CHEBI:16189 name: sulfate subset: chebi_ph7_3 is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:33482 ! sulfur oxoanion is_a: CHEBI:48154 ! sulfur oxide is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16190 name: cis-cyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:18887 ! cyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:16192 name: 2'-deoxyguanosine 5'-monophosphate is_a: CHEBI:23625 ! deoxyguanosine phosphate is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:63573 ! guanyl deoxyribonucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16193 name: 3-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16196 name: oleic acid is_a: CHEBI:36021 ! octadec-9-enoic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite [Term] id: CHEBI:16197 name: N-acylsphingosine 1-phosphate is_a: CHEBI:13956 ! ceramide 1-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16199 name: urea subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:33287 ! fertilizer relationship: has_role CHEBI:64577 ! flour treatment agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16200 name: questin is_a: CHEBI:37484 ! dihydroxyanthraquinone [Term] id: CHEBI:16204 name: phloroglucinol subset: chebi_ph7_3 is_a: CHEBI:139520 ! phenolic donor is_a: CHEBI:22707 ! benzenetriol relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16205 name: biphenyl-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:24681 ! hydroxybiphenyls is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:16206 name: sn-3-O-(geranylgeranyl)glycerol 1-phosphate is_a: CHEBI:48869 ! 3-O-(geranylgeranyl)glycerol 1-phosphate [Term] id: CHEBI:16207 name: 3-hydroxybenzaldehyde subset: chebi_ph7_3 is_a: CHEBI:24673 ! hydroxybenzaldehyde [Term] id: CHEBI:16208 name: 3-mercaptopyruvic acid is_a: CHEBI:29256 ! thiol is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:90749 ! antidote to cyanide poisoning [Term] id: CHEBI:16209 name: hypotaurocyamine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:37783 ! organosulfinic acid [Term] id: CHEBI:16210 name: sinapoyltartronic acid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:16211 name: cis-2-chloro-4-carboxymethylenebut-2-en-1,4-olide is_a: CHEBI:23140 ! chlorodienelactone is_a: CHEBI:38122 ! 2-chloro-4-carboxymethylenebut-2-en-1,4-olide [Term] id: CHEBI:16213 name: coformycin is_a: CHEBI:39304 ! coformycins relationship: has_role CHEBI:50445 ! EC 3.5.4.4 (adenosine deaminase) inhibitor [Term] id: CHEBI:16214 name: dolichyl phosphate is_a: CHEBI:23875 ! dolichol phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16215 name: phosphonate(2-) subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:16216 name: 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:16217 name: D-glucono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:24267 ! gluconolactone is_a: CHEBI:74105 ! aldono-1,5-lactone relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16218 name: beta-D-glucose 1-phosphate is_a: CHEBI:16077 ! D-glucopyranose 1-phosphate [Term] id: CHEBI:16219 name: cucurbitacin is_a: CHEBI:26893 ! tetracyclic triterpenoid relationship: has_role CHEBI:62215 ! allelochemical [Term] id: CHEBI:16220 name: coniferin subset: chebi_ph7_3 is_a: CHEBI:20346 ! cinnamyl alcohol beta-D-glucoside is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16221 name: sn-glycerol 1-phosphate is_a: CHEBI:14336 ! glycerol 1-phosphate is_a: CHEBI:37528 ! sn-glycerol 1-phosphates relationship: has_role CHEBI:78947 ! archaeal metabolite [Term] id: CHEBI:16222 name: D-galacto-hexodialdose subset: chebi_ph7_3 is_a: CHEBI:33926 ! dialdose [Term] id: CHEBI:16223 name: dimethylarsinate subset: chebi_ph7_3 is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:16224 name: alpha-D-mannopyranuronic acid is_a: CHEBI:79047 ! D-mannopyranuronic acid [Term] id: CHEBI:162247 name: 2-cis,6-trans-farnesyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:16225 name: S-formylglutathione is_a: CHEBI:18126 ! S-acylglutathione relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16226 name: limonin subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:25000 ! lactone is_a: CHEBI:32955 ! epoxide is_a: CHEBI:39434 ! limonoid is_a: CHEBI:51914 ! organic heterohexacyclic compound is_a: CHEBI:70994 ! hexacyclic triterpenoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35222 ! inhibitor [Term] id: CHEBI:16227 name: pyridine subset: chebi_ph7_3 is_a: CHEBI:26421 ! pyridines is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene is_a: CHEBI:50893 ! azaarene relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:16228 name: 2,2-dialkylglycine is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:16229 name: 3beta-hydroxy-5beta-pregnan-20-one subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:50171 ! 3-hydroxy-5beta-pregnan-20-one relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16230 name: 5-hydroxypentanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:16231 name: cis-4-hydroxy-D-proline is_a: CHEBI:144637 ! 4-hydroxy-D-proline relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16232 name: N(6)-acyl-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid [Term] id: CHEBI:16233 name: (S)-cheilanthifoline subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:16234 name: hydroxide is_a: CHEBI:33693 ! oxygen hydride relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16235 name: guanine subset: chebi_ph7_3 is_a: CHEBI:20702 ! 2-aminopurines is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:26386 ! purine nucleobase relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16236 name: ethanol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23982 ! ethanols is_a: CHEBI:50584 ! alkyl alcohol relationship: has_role CHEBI:35488 ! central nervous system depressant relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:48354 ! polar solvent relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:64018 ! protein kinase C agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16237 name: 4-chlorophenylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:16238 name: FAD is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:24040 ! flavin adenine dinucleotide relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16239 name: benzyl (2R,3S)-3-hydroxy-2-methylbutanoate subset: chebi_ph7_3 is_a: CHEBI:22748 ! benzyl 2-methyl-3-hydroxybutanoate [Term] id: CHEBI:1624 name: 3-oxo-5beta-steroid subset: chebi_ph7_3 is_a: CHEBI:136889 ! 5beta steroid is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:16240 name: hydrogen peroxide subset: chebi_ph7_3 is_a: CHEBI:24837 ! inorganic peroxide is_a: CHEBI:26523 ! reactive oxygen species relationship: has_role CHEBI:132717 ! bleaching agent relationship: has_role CHEBI:149552 ! emetic relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:63248 ! oxidising agent relationship: has_role CHEBI:63490 ! explosive relationship: has_role CHEBI:65259 ! GABA antagonist relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16241 name: aldehydo-D-arabinose 5-phosphate is_a: CHEBI:79058 ! D-arabinose 5-phosphate [Term] id: CHEBI:16243 name: quercetin is_a: CHEBI:25883 ! pentahydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:37699 ! protein kinase inhibitor relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:70770 ! Aurora kinase inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen relationship: has_role CHEBI:77020 ! EC 1.10.99.2 [ribosyldihydronicotinamide dehydrogenase (quinone)] inhibitor [Term] id: CHEBI:16244 name: 4-(trimethylammonio)butanoate subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16246 name: D-ribitol 5-phosphate is_a: CHEBI:37534 ! ribitol 5-phosphate [Term] id: CHEBI:16247 name: phospholipid subset: chebi_ph7_3 is_a: CHEBI:18059 ! lipid is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:16250 name: N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16251 name: deaminohydroxyblasticidin S is_a: CHEBI:22905 ! blasticidin [Term] id: CHEBI:16252 name: 6-methoxymellein subset: chebi_ph7_3 is_a: CHEBI:38762 ! isochromanes [Term] id: CHEBI:16253 name: 2-(acetamidomethylidene)succinic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:16254 name: 11-cis-retinyl palmitate subset: chebi_ph7_3 is_a: CHEBI:15040 ! retinyl palmitate is_a: CHEBI:195358 ! 11-cis-retinyl ester relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16255 name: L-histidinol is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:24780 ! imidazoles relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78691 ! EC 2.3.1.97 (glycylpeptide N-tetradecanoyltransferase) inhibitor [Term] id: CHEBI:16256 name: 2-methyl-3-oxopropanoic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:16257 name: 5-O-(1-carboxyvinyl)-3-phosphoshikimic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid is_a: CHEBI:37412 ! phosphoshikimic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16259 name: N-acetyl-L-phenylalanine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:21626 ! N-acetylphenylalanine is_a: CHEBI:77673 ! N-acyl-L-phenylalanine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16260 name: 2-nitrophenol is_a: CHEBI:86421 ! 2-nitrophenols [Term] id: CHEBI:16261 name: chitosan is_a: CHEBI:22506 ! aminoglycan is_a: CHEBI:72813 ! exopolysaccharide relationship: has_role CHEBI:192504 ! elicitor relationship: has_role CHEBI:73182 ! plant activator relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16264 name: UDP-N-acetyl-alpha-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16265 name: succinic semialdehyde is_a: CHEBI:26643 ! aldehydic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16266 name: 2,3-bis-O-(geranylgeranyl)glycerol 1-phosphate is_a: CHEBI:24232 ! geranylgeranylglycerol 1-phosphate [Term] id: CHEBI:16267 name: (R)-4-hydroxymandelonitrile beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:16268 name: nitroethane subset: chebi_ph7_3 is_a: CHEBI:133972 ! primary nitroalkane [Term] id: CHEBI:16269 name: N,N-dimethylaniline subset: chebi_ph7_3 is_a: CHEBI:23806 ! dimethylaniline is_a: CHEBI:32876 ! tertiary amine [Term] id: CHEBI:16270 name: benzoylagmatine is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:16271 name: 2-exo-hydroxy-1,8-cineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole [Term] id: CHEBI:16273 name: 2-amino-3-oxo-4-(phosphonooxy)butanoic acid is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:16274 name: 5,12-dihydroxanthommatin is_a: CHEBI:27323 ! xanthommatins [Term] id: CHEBI:16275 name: all-trans-octaprenyl diphosphate is_a: CHEBI:53045 ! octaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16277 name: haloacetic acid is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:16278 name: 2-hydroxy-3-oxoadipic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:16279 name: 1-O-trans-cinnamoyl-beta-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:16281 name: 3-(2-carboxyethenyl)-cis,cis-muconic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:16282 name: 2-ureidoglycine is_a: CHEBI:47857 ! ureas is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:16283 name: L-cystine is_a: CHEBI:17376 ! cystine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:145814 ! EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitor relationship: has_role CHEBI:64577 ! flour treatment agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16284 name: dATP is_a: CHEBI:19237 ! 2'-deoxyadenosine 5'-phosphate is_a: CHEBI:37042 ! purine 2'-deoxyribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16285 name: phytanic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:16286 name: 3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carbaldehyde subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:16287 name: UDP-N-acetyl-D-mannosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:16288 name: O-acetyl-L-homoserine is_a: CHEBI:22195 ! acetyl-amino acid is_a: CHEBI:7671 ! O-acetylhomoserine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16289 name: beta-D-galactosyl group subset: chebi_ph7_3 is_a: CHEBI:22778 ! beta-D-galactosyl groups is_a: CHEBI:24164 ! galactosyl group [Term] id: CHEBI:16290 name: 5alpha-cholesta-7,24-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16291 name: 1-alkyl-2-acetyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:598 ! 1-alkyl-2-acylglycerol is_a: CHEBI:75882 ! 1-alkyl-2-acetylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16292 name: D-arabinono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:37422 ! arabinono-1,4-lactone relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16294 name: barbituric acid is_a: CHEBI:22693 ! barbiturates relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:16295 name: alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->6)-alpha-D-glucosyl-(1->3')-1-alkyl-2-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:16296 name: D-tryptophan is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:27897 ! tryptophan relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16297 name: N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16298 name: D-mannitol 1-phosphate is_a: CHEBI:22292 ! alditol 1-phosphate is_a: CHEBI:24582 ! hexitol phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16299 name: dehydrocoformycin is_a: CHEBI:39304 ! coformycins [Term] id: CHEBI:16300 name: alpha-D-ribose 1-phosphate is_a: CHEBI:35425 ! D-ribose 1-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16301 name: nitrite subset: chebi_ph7_3 is_a: CHEBI:33458 ! nitrogen oxoanion is_a: CHEBI:62764 ! reactive nitrogen species is_a: CHEBI:79389 ! monovalent inorganic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16302 name: 11-cis-retinol subset: chebi_ph7_3 is_a: CHEBI:50211 ! retinol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16303 name: 3-amino-L-alanine is_a: CHEBI:18383 ! 3-aminoalanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:16304 name: cob(II)alamin subset: chebi_ph7_3 is_a: CHEBI:30411 ! cobalamin relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16305 name: N(2),N(5)-dibenzoyl-L-ornithine is_a: CHEBI:21806 ! N(2),N(5)-diacyl-L-ornithine [Term] id: CHEBI:16307 name: anthocyanidin 3-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:16308 name: sucrose 6(F)-phosphate is_a: CHEBI:23843 ! disaccharide phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16309 name: 4-sulfobenzoate(1-) is_a: CHEBI:38036 ! sulfobenzoate [Term] id: CHEBI:16310 name: sulcatone subset: chebi_ph7_3 is_a: CHEBI:24523 ! heptenone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:72575 ! alarm pheromone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16311 name: dCTP is_a: CHEBI:37043 ! pyrimidine 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16312 name: 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid [Term] id: CHEBI:16313 name: D-proline is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:26271 ! proline relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16314 name: N-formylmethanofuran is_a: CHEBI:35743 ! pentacarboxylic acid [Term] id: CHEBI:16315 name: morphinone is_a: CHEBI:25418 ! morphinane alkaloid [Term] id: CHEBI:16317 name: 3alpha-hydroxyglycyrrhetinic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:16318 name: 4-nitrocatechol is_a: CHEBI:33566 ! catechols is_a: CHEBI:35716 ! C-nitro compound relationship: has_role CHEBI:35856 ! lipoxygenase inhibitor relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16319 name: 2-acetamido-5-oxopentanoic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:24313 ! glutamic semialdehyde [Term] id: CHEBI:16320 name: (R)-3-aminoisobutyric acid is_a: CHEBI:27389 ! 3-aminoisobutyric acid [Term] id: CHEBI:16321 name: 4-carboxy-2-hydroxyhexa-2,4-dienedioic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:33823 ! enol [Term] id: CHEBI:16322 name: myo-inositol 1,3,4,5,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16324 name: rifamycin O subset: chebi_ph7_3 is_a: CHEBI:26580 ! rifamycins [Term] id: CHEBI:16325 name: lithocholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16326 name: alpha-D-hexose 1-phosphate is_a: CHEBI:24588 ! hexose 1-phosphate [Term] id: CHEBI:16327 name: 2-oxosuccinamic acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:16329 name: UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysine is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:16330 name: 17beta-hydroxy-5alpha-androstan-3-one subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:85278 ! 17beta-hydroxyandrostan-3-one relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16331 name: phloretate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:16332 name: D-xylulose 5-phosphate is_a: CHEBI:27354 ! xylulose 5-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16333 name: 2-arylpropionic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:16335 name: adenosine subset: chebi_ph7_3 is_a: CHEBI:142355 ! purines D-ribonucleoside is_a: CHEBI:22260 ! adenosines relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:38070 ! anti-arrhythmia drug relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16336 name: hyaluronic acid is_a: CHEBI:37395 ! mucopolysaccharide is_a: CHEBI:72813 ! exopolysaccharide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16337 name: phosphatidic acid is_a: CHEBI:37739 ! glycerophospholipid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16338 name: 4-hydroxy-L-glutamate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:16342 name: L-5-carboxymethylhydantoin is_a: CHEBI:24628 ! imidazolidine-2,4-dione [Term] id: CHEBI:16343 name: phenylethanolamine is_a: CHEBI:25990 ! phenylethanolamines relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16344 name: guanidinoacetic acid is_a: CHEBI:24439 ! guanidinoacetic acids relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:16345 name: 3-sulfino-L-alanine is_a: CHEBI:37783 ! organosulfinic acid is_a: CHEBI:47910 ! S-substituted L-cysteine relationship: has_role CHEBI:61966 ! metabotropic glutamate receptor agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16346 name: (S)-1-phenylethanol subset: chebi_ph7_3 is_a: CHEBI:669 ! 1-phenylethanol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16347 name: (R)-carnitine subset: chebi_ph7_3 is_a: CHEBI:17126 ! carnitine relationship: has_role CHEBI:27314 ! water-soluble vitamin (role) relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:66980 ! nootropic agent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16348 name: 3-nitropropanoic acid is_a: CHEBI:35716 ! C-nitro compound relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:64912 ! antimycobacterial drug relationship: has_role CHEBI:83072 ! EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor [Term] id: CHEBI:16349 name: L-citrulline is_a: CHEBI:18211 ! citrulline relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50267 ! protective agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16350 name: 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:37016 ! 2'-deoxyribonucleoside 5'-phosphate [Term] id: CHEBI:16351 name: 2-(alpha-D-mannosyl)-3-phosphoglyceric acid is_a: CHEBI:25405 ! monophosphoglyceric acid [Term] id: CHEBI:16352 name: 4-hydroxy-1-pyrroline-2-carboxylic acid is_a: CHEBI:19098 ! 1-pyrrolinecarboxylic acid is_a: CHEBI:23591 ! dehydroamino acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16353 name: sinapine subset: chebi_ph7_3 is_a: CHEBI:35287 ! acylcholine relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:26087 ! photosynthetic electron-transport chain inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16354 name: N-methylhydantoin subset: chebi_ph7_3 is_a: CHEBI:24628 ! imidazolidine-2,4-dione relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16355 name: 1-iodo-2-methoxybenzene subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:16356 name: 3',5'-cyclic GMP is_a: CHEBI:19834 ! 3',5'-cyclic purine nucleotide is_a: CHEBI:61295 ! guanyl ribonucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16357 name: 3-(pyrazol-1-yl)-L-alanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:16358 name: (R)-vicianin subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:16359 name: cholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:27114 ! trihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16362 name: D-aldose is_a: CHEBI:15693 ! aldose [Term] id: CHEBI:16363 name: alpha-santonin subset: chebi_ph7_3 is_a: CHEBI:26604 ! santonin is_a: CHEBI:86494 ! botanical anti-fungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16364 name: pyridine-2,5-diol subset: chebi_ph7_3 is_a: CHEBI:23793 ! dihydroxypyridine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16365 name: quinolin-2-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16366 name: anthocyanidin cation subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:47916 ! flavonoid [Term] id: CHEBI:16367 name: N(tele)-methyl-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:16368 name: 6-hydroxymellein subset: chebi_ph7_3 is_a: CHEBI:38762 ! isochromanes [Term] id: CHEBI:16369 name: 5-dehydro-4-deoxy-D-glucaric acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:16370 name: dihydrophloroglucinol is_a: CHEBI:16204 ! phloroglucinol [Term] id: CHEBI:16372 name: 4,5alpha-dihydrocortisone subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:23736 ! 4,5-dihydrocortisone [Term] id: CHEBI:16373 name: (S)-3-(imidazol-5-yl)lactic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:27487 ! 3-(imidazol-5-yl)lactic acid [Term] id: CHEBI:16374 name: menaquinone subset: chebi_ph7_3 is_a: CHEBI:25185 ! menaquinones is_a: CHEBI:28384 ! vitamin K relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16375 name: D-cysteine is_a: CHEBI:15356 ! cysteine is_a: CHEBI:16733 ! D-alpha-amino acid [Term] id: CHEBI:16377 name: sabinene hydrate subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:16378 name: threo-3-methyl-L-aspartate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:16379 name: Co-methyl-Co-5-hydroxybenzimidazolylcob(III)amide subset: chebi_ph7_3 is_a: CHEBI:23341 ! cobamides [Term] id: CHEBI:16380 name: vindoline is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27288 ! vinca alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:16381 name: 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:37016 ! 2'-deoxyribonucleoside 5'-phosphate [Term] id: CHEBI:16382 name: iodide subset: chebi_ph7_3 is_a: CHEBI:16042 ! halide anion is_a: CHEBI:36897 ! monoatomic iodine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16383 name: cis-aconitate(3-) subset: chebi_ph7_3 is_a: CHEBI:22210 ! aconitate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16384 name: trans-5-O-caffeoyl-D-quinic acid is_a: CHEBI:36087 ! cinnamate ester is_a: CHEBI:36123 ! cyclitol carboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16385 name: organic sulfide is_a: CHEBI:26822 ! sulfide is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:16387 name: (R)-N-methylcoclaurine is_a: CHEBI:38818 ! N-methylcoclaurine [Term] id: CHEBI:16388 name: 4-hydroxymandelic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16389 name: ubiquinones subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones is_a: CHEBI:26255 ! prenylquinone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16390 name: 3alpha,12alpha-dihydroxy-7-oxo-5beta-cholanic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:47789 ! 7-oxo steroid [Term] id: CHEBI:16392 name: D-xylono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:27347 ! xylonolactone relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16393 name: sphingosine is_a: CHEBI:26743 ! sphing-4-enine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16394 name: N-methylanthranilic acid is_a: CHEBI:33856 ! aromatic amino acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16395 name: N-acetoxy-1,1'-biphenyl-4-amine subset: chebi_ph7_3 is_a: CHEBI:21494 ! N-acetoxyarylamine [Term] id: CHEBI:16397 name: formamide subset: chebi_ph7_3 is_a: CHEBI:24079 ! formamides is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:46787 ! solvent [Term] id: CHEBI:16398 name: D-threonine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:26986 ! threonine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16399 name: N(3)-oxalyl-L-2,3-diaminopropionic acid is_a: CHEBI:52648 ! N(beta)-acyl-L-2,3-diaminopropionic acid [Term] id: CHEBI:16400 name: gossypetin is_a: CHEBI:24561 ! hexahydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16404 name: 3-oxoglycyrrhetinic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:16405 name: beta-D-Xylp-(1->6)-beta-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:146448 ! beta-D-Xylp-(1->6)-D-Glcp [Term] id: CHEBI:16406 name: 5'-acylphosphoadenosine is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:16408 name: vomilenine subset: chebi_ph7_3 is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:16409 name: 5-pyridoxic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:26420 ! pyridinemonocarboxylic acid is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38196 ! hydroxymethylpyridine relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:16410 name: pyridoxamine is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38196 ! hydroxymethylpyridine is_a: CHEBI:38198 ! aminoalkylpyridine relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76595 ! nephroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16411 name: indole-3-acetic acid is_a: CHEBI:24803 ! indole-3-acetic acids is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:22676 ! auxin relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16412 name: lipopolysaccharide is_a: CHEBI:35740 ! liposaccharide is_a: CHEBI:65212 ! polysaccharide derivative relationship: has_part CHEBI:64637 ! O-polysaccharide [Term] id: CHEBI:16413 name: but-2-yne-1,4-diol subset: chebi_ph7_3 is_a: CHEBI:22970 ! butynediol [Term] id: CHEBI:16414 name: L-valine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:26463 ! pyruvate family amino acid is_a: CHEBI:27266 ! valine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16415 name: protopine subset: chebi_ph7_3 is_a: CHEBI:38608 ! dibenzazecine alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16419 name: limonoic acid is_a: CHEBI:24129 ! furans is_a: CHEBI:32955 ! epoxide is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:39434 ! limonoid [Term] id: CHEBI:16421 name: 1-deoxy-D-altro-heptulose 7-phosphate is_a: CHEBI:35133 ! ketoheptose phosphate is_a: CHEBI:63403 ! sedoheptulose derivative [Term] id: CHEBI:16422 name: androst-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16423 name: (9Z)-octadec-9-en-12-ynoic acid is_a: CHEBI:25635 ! octadecenynoic acid [Term] id: CHEBI:16424 name: phenylacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:25973 ! phenylacetaldehydes is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16425 name: 16-epivellosimine subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16426 name: 3-(imidazol-4-yl)-2-oxopropyl dihydrogen phosphate is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:36948 ! oxoalkyl phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16427 name: mono(glucosyluronic acid)bilirubin is_a: CHEBI:22872 ! (glucosyluronic acid)bilirubin [Term] id: CHEBI:16428 name: 4-coumaroylshikimic acid is_a: CHEBI:23483 ! cyclohexenecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:16430 name: precorrin-4 is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:16431 name: limonene 1,2-epoxide subset: chebi_ph7_3 is_a: CHEBI:25040 ! limonene monoterpenoid is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16433 name: trans-caffeic acid is_a: CHEBI:36281 ! caffeic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16434 name: N-hydroxy-4-acetylaminobiphenyl subset: chebi_ph7_3 is_a: CHEBI:24650 ! hydroxamic acid [Term] id: CHEBI:16435 name: UDP-N-acetyl-3-O-(1-carboxyvinyl)-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:16436 name: CDP-choline is_a: CHEBI:25604 ! nucleotide-(amino alcohol)s is_a: CHEBI:36700 ! phosphocholines relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16437 name: N-acetyl-L-histidine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:84076 ! L-histidine derivative is_a: CHEBI:86910 ! N-acetylhistidine relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:16439 name: N-(carboxymethyl)-D-alanine is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:16440 name: N-methyl-L-glutamic acid is_a: CHEBI:149778 ! methyl-L-glutamic acid is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16441 name: linamarin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:16443 name: D-tagatose is_a: CHEBI:33954 ! tagatose relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:16444 name: 2-acetyllactic acid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16445 name: stipitatonic acid is_a: CHEBI:36609 ! cyclic dicarboxylic anhydride is_a: CHEBI:39435 ! cycloheptafuran [Term] id: CHEBI:16446 name: N-acetyl-alpha-D-glucosamine 1-phosphate is_a: CHEBI:7125 ! 2-acetamido-2-deoxy-D-glucopyranose 1-phosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16449 name: alanine is_a: CHEBI:33704 ! alpha-amino acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16450 name: 2'-deoxyuridine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16452 name: oxaloacetate(2-) subset: chebi_ph7_3 is_a: CHEBI:133294 ! oxo dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16453 name: 1,4,5,6-tetrahydro-6-oxonicotinic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:16454 name: pantothenate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16455 name: 4,4-dimethyl-5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:16456 name: 2-(2-hydroxyacyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:16457 name: S,S-dimethyl-beta-propiothetin subset: chebi_ph7_3 is_a: CHEBI:35282 ! sulfonium betaine relationship: has_role CHEBI:25728 ! osmolyte relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:16458 name: triacetate lactone subset: chebi_ph7_3 is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:16459 name: pentanamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:16460 name: polyprenol phosphate is_a: CHEBI:26250 ! prenol phosphate is_a: CHEBI:26875 ! terpenyl phosphate [Term] id: CHEBI:16461 name: tauropine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:33551 ! organosulfonic acid is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:16463 name: N-methylethanolamine phosphate is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:16464 name: salicyl alcohol subset: chebi_ph7_3 is_a: CHEBI:24679 ! hydroxybenzyl alcohol is_a: CHEBI:33857 ! aromatic primary alcohol relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:16466 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:36884 ! 26-oxo steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16467 name: L-arginine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:24318 ! glutamine family amino acid is_a: CHEBI:29016 ! arginine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16468 name: maleylacetate subset: chebi_ph7_3 is_a: CHEBI:12040 ! 4-oxohex-2-enedioate [Term] id: CHEBI:16469 name: 17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:23965 ! estradiol is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:62872 ! EC 1.2.3.1 (aldehyde oxidase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16470 name: glyceollin subset: chebi_ph7_3 is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:16471 name: (dimethylsulfonio)acetate subset: chebi_ph7_3 is_a: CHEBI:35282 ! sulfonium betaine [Term] id: CHEBI:16472 name: pentan-2-one subset: chebi_ph7_3 is_a: CHEBI:25892 ! pentanone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16473 name: cortisol 21-sulfate is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:23396 ! cortisol ester is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16474 name: NADPH is_a: CHEBI:13392 ! NAD(P)H is_a: CHEBI:25523 ! NADP relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16475 name: 2-[3-carboxy-3-(methylammonio)propyl]-L-histidine is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:16478 name: N-acetyl-beta-D-glucosaminyl-1,6-(N-acetyl-beta-D-glucosaminyl-1,3)-N-acetyl-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16479 name: streptomycin 6-phosphate is_a: CHEBI:26787 ! streptomycin phosphate [Term] id: CHEBI:16480 name: nitric oxide subset: chebi_ph7_3 is_a: CHEBI:35196 ! nitrogen oxide is_a: CHEBI:36871 ! inorganic radical is_a: CHEBI:62764 ! reactive nitrogen species relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16481 name: N-(hydroxymethyl)urea subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:16482 name: naphthalene subset: chebi_ph7_3 is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:35426 ! ortho-fused bicyclic arene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:16483 name: isonocardicin A is_a: CHEBI:25572 ! nocardicin is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:16485 name: 18-hydroxycorticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36855 ! 18-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47788 ! 3-oxo steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16486 name: cyclopentanone subset: chebi_ph7_3 is_a: CHEBI:36140 ! cyclopentanones relationship: has_role CHEBI:77523 ! Maillard reaction product [Term] id: CHEBI:16487 name: benzyl cetraxate is_a: CHEBI:23084 ! cetraxates is_a: CHEBI:90628 ! benzyl ester [Term] id: CHEBI:16488 name: meso-2,6-diaminopimelic acid is_a: CHEBI:23673 ! 2,6-diaminopimelic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16489 name: lumazine subset: chebi_ph7_3 is_a: CHEBI:73186 ! 2,4-dihydroxypteridine [Term] id: CHEBI:16490 name: S-adenosyl-4-methylthio-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:35282 ! sulfonium betaine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16492 name: nucleoside 3'-phosphate is_a: CHEBI:29075 ! mononucleotide [Term] id: CHEBI:16493 name: 1-deoxy-D-xylulose 5-phosphate is_a: CHEBI:27355 ! xylulose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16494 name: lipoic acid is_a: CHEBI:39192 ! dithiolanes is_a: CHEBI:48847 ! heterocyclic fatty acid is_a: CHEBI:59643 ! thia fatty acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16495 name: 4alpha-methyllathosterone subset: chebi_ph7_3 is_a: CHEBI:71598 ! 3-oxo Delta(7)-steroid [Term] id: CHEBI:16496 name: 5beta-cholestane-3alpha,7alpha,12alpha-triol subset: chebi_ph7_3 is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16497 name: dGTP is_a: CHEBI:23625 ! deoxyguanosine phosphate is_a: CHEBI:37042 ! purine 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:63573 ! guanyl deoxyribonucleotide relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16498 name: N-acylneuraminic acid is_a: CHEBI:26667 ! sialic acid [Term] id: CHEBI:165 name: (1S,4R)-fenchone subset: chebi_ph7_3 is_a: CHEBI:4999 ! fenchone [Term] id: CHEBI:16500 name: 1-phosphatidyl-1D-myo-inositol 5-phosphate is_a: CHEBI:37329 ! phosphatidylinositol 5-phosphate [Term] id: CHEBI:16501 name: L-arabinonate subset: chebi_ph7_3 is_a: CHEBI:22595 ! arabinonate [Term] id: CHEBI:16503 name: selane is_a: CHEBI:36903 ! selenium hydride is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16504 name: monodehydro-L-ascorbic acid is_a: CHEBI:36872 ! organic radical relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16505 name: dihydrostreptomycin 6-phosphate is_a: CHEBI:26787 ! streptomycin phosphate [Term] id: CHEBI:16506 name: N-acetyl-beta-D-glucosaminyl-(1->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide [Term] id: CHEBI:16507 name: 1D-myo-inositol 1,2,4,5,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate [Term] id: CHEBI:16508 name: cis,cis-muconic acid is_a: CHEBI:38407 ! muconic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16509 name: 1,4-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16510 name: 3-hydroxypropionate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16511 name: N-acetyl-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:21635 ! N-acyl-D-glucosamine 1-phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16512 name: (S)-N-methylcanadine subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:16513 name: hydroxymalonic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16514 name: 4',5,7-trihydroxy-3'-methoxyflavone is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:16515 name: 3-ADP-glyceric acid is_a: CHEBI:25405 ! monophosphoglyceric acid is_a: CHEBI:37398 ! nucleotide-aldonic acid is_a: CHEBI:63455 ! tetronic acid derivative [Term] id: CHEBI:16516 name: 2'-deoxyribonucleoside triphosphate is_a: CHEBI:17326 ! nucleoside 5'-triphoshate [Term] id: CHEBI:16517 name: cyclotriphosphoric acid is_a: CHEBI:33457 ! phosphorus oxoacid is_a: CHEBI:33596 ! inorganic heterocyclic compound is_a: CHEBI:37798 ! cyclic phosphorus acid anhydride [Term] id: CHEBI:16520 name: R'C(R)SH subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound relationship: has_part CHEBI:29917 ! thiol group [Term] id: CHEBI:16521 name: lanosterol subset: chebi_ph7_3 is_a: CHEBI:138029 ! 14alpha-methyl steroid is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16522 name: trans-zeatin subset: chebi_ph7_3 is_a: CHEBI:15333 ! zeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16523 name: D-serine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:17822 ! serine relationship: has_role CHEBI:64571 ! NMDA receptor agonist relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16524 name: testosterone acetate subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16525 name: taurochenodeoxycholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16526 name: carbon dioxide subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:23014 ! carbon oxide is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:38867 ! anaesthetic relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:48706 ! antagonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76413 ! greenhouse gas relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77974 ! food packaging gas relationship: has_role CHEBI:78017 ! food propellant relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:165279 name: 11-HpETE is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:16530 name: 3-methyl-2-oxobutanoic acid is_a: CHEBI:191197 ! branched-chain keto acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16531 name: Renilla luciferin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:37847 ! imidazopyrazine relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:16532 name: N-benzyloxycarbonylglycine is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:16533 name: L-tryptophanamide is_a: CHEBI:22475 ! amino acid amide is_a: CHEBI:27164 ! tryptophan derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16534 name: D-galactonic acid is_a: CHEBI:24149 ! galactonic acid [Term] id: CHEBI:16535 name: piperazine-2,5-dione subset: chebi_ph7_3 is_a: CHEBI:23449 ! cyclic peptide is_a: CHEBI:65061 ! 2,5-diketopiperazines [Term] id: CHEBI:16536 name: orcinol subset: chebi_ph7_3 is_a: CHEBI:52679 ! 5-alkylresorcinol is_a: CHEBI:64532 ! dihydroxytoluene relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:16537 name: galactarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:48871 ! galactaric acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16540 name: pyridin-2-ol subset: chebi_ph7_3 is_a: CHEBI:38182 ! monohydroxypyridine relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16541 name: protein polypeptide chain is_a: CHEBI:15841 ! polypeptide relationship: has_part CHEBI:33700 ! proteinogenic amino-acid residue [Term] id: CHEBI:16542 name: L-serine phosphoethanolamine is_a: CHEBI:15916 ! serine phosphoethanolamine [Term] id: CHEBI:16543 name: N(2)-acetyl-L-ornithine is_a: CHEBI:21815 ! N2-acyl-L-ornithine is_a: CHEBI:86496 ! acetyl-L-ornithine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16544 name: UDP-N-acetyl-D-galactosamine 4,6-bissulfate is_a: CHEBI:37861 ! nucleotide-sugar sulfate [Term] id: CHEBI:16545 name: 5-valerolactone subset: chebi_ph7_3 is_a: CHEBI:18946 ! delta-lactone [Term] id: CHEBI:16546 name: 1-O-sinapoyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:24282 ! glucosyl hydroxycinnamic acid is_a: CHEBI:36087 ! cinnamate ester is_a: CHEBI:51681 ! dimethoxybenzene is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16547 name: coniferyl aldehyde subset: chebi_ph7_3 is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:23245 ! cinnamaldehydes is_a: CHEBI:26004 ! phenylpropanoid relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:165475 name: 5,8,11-eicosatrienoic acid is_a: CHEBI:36036 ! fatty acid 20:3 [Term] id: CHEBI:16548 name: chlordecone subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:16549 name: UDP-2-acetamido-4-amino-2,4,6-trideoxy-D-glucose is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:16550 name: xanthommatin is_a: CHEBI:27323 ! xanthommatins [Term] id: CHEBI:16551 name: alpha,alpha-trehalose subset: chebi_ph7_3 is_a: CHEBI:27082 ! trehalose relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16552 name: N-formyl-L-methionine is_a: CHEBI:50759 ! N-formyl amino acid is_a: CHEBI:83813 ! proteinogenic amino acid is_a: CHEBI:84121 ! L-methionine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16553 name: UDP-4-dehydro-6-deoxy-D-glucose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:16554 name: sym-homospermidine is_a: CHEBI:38751 ! triamine is_a: CHEBI:39474 ! polyazaalkane [Term] id: CHEBI:16555 name: ethanethioic S-acid is_a: CHEBI:26952 ! thioacetic acid [Term] id: CHEBI:16556 name: CMP-N-acetyl-beta-neuraminic acid is_a: CHEBI:16788 ! CMP-N-acyl-beta-neuraminic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16557 name: quercetin 3,3',7-trissulfate is_a: CHEBI:26483 ! quercetin trissulfate is_a: CHEBI:38686 ! dihydroxyflavone [Term] id: CHEBI:16558 name: triacetic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:16562 name: 2-phenylacetamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16563 name: tetrahydropalmatine subset: chebi_ph7_3 is_a: CHEBI:194528 ! an (S)-7,8,13,14-tetrahydroprotoberberine is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:37962 ! adrenergic agent relationship: has_role CHEBI:48561 ! dopaminergic antagonist [Term] id: CHEBI:16566 name: sphinganine is_a: CHEBI:46968 ! 2-aminooctadecane-1,3-diol relationship: has_role CHEBI:37700 ! EC 2.7.11.13 (protein kinase C) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16567 name: anthranilate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16568 name: 5,10-methylenetetrahydromethanopterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:16569 name: 3-hydroxyquinolin-4(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:16570 name: N(6)-hydroxy-L-lysine is_a: CHEBI:24661 ! hydroxy-L-lysine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:16571 name: oxidised poly(vinyl alcohol) subset: chebi_ph7_3 is_a: CHEBI:37997 ! homopolymer macromolecule [Term] id: CHEBI:16572 name: 3-ethylcatechol subset: chebi_ph7_3 is_a: CHEBI:20016 ! 3-ethylcatechols [Term] id: CHEBI:16573 name: carbonyl sulfide subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:16576 name: D-alanyl-D-alanine is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16577 name: 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16578 name: 4-CDP-2-C-methyl-D-erythritol is_a: CHEBI:22294 ! alditol 4-phosphate is_a: CHEBI:26980 ! tetritol phosphate is_a: CHEBI:35240 ! nucleotide-alditol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16579 name: anisole subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16581 name: pregnenolone subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16582 name: oxaluric acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16583 name: butane-2,3-dione subset: chebi_ph7_3 is_a: CHEBI:51869 ! alpha-diketone relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16584 name: isopentenyl diphosphate is_a: CHEBI:26250 ! prenol phosphate relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:59544 ! phosphoantigen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16585 name: L-lombricine is_a: CHEBI:25072 ! lombricine [Term] id: CHEBI:16586 name: 6-aminohexanoic acid is_a: CHEBI:35958 ! epsilon-amino acid is_a: CHEBI:59758 ! omega-amino fatty acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48675 ! antifibrinolytic drug relationship: has_role CHEBI:50248 ! hematologic agent [Term] id: CHEBI:16587 name: 20-hydroxyecdysone subset: chebi_ph7_3 is_a: CHEBI:23897 ! ecdysteroid is_a: CHEBI:26118 ! phytoecdysteroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:36859 ! 2beta-hydroxy steroid is_a: CHEBI:36861 ! 14alpha-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36864 ! 25-hydroxy steroid relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:165870 name: N-6-Trimethyllysine is_a: CHEBI:15705 ! L-alpha-amino acid [Term] id: CHEBI:16588 name: D-hamamelose 2(1)-(dihydrogen phosphate) is_a: CHEBI:35160 ! phosphomethylribose [Term] id: CHEBI:16590 name: O-feruloylgalactaric acid is_a: CHEBI:24138 ! galactaric acid derivative is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:16591 name: all-trans-undecaprenol subset: chebi_ph7_3 is_a: CHEBI:27191 ! undecaprenols is_a: CHEBI:77396 ! long-chain primary fatty alcohol [Term] id: CHEBI:16592 name: (S)-canadine subset: chebi_ph7_3 is_a: CHEBI:194528 ! an (S)-7,8,13,14-tetrahydroprotoberberine is_a: CHEBI:22998 ! canadine relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16593 name: L-xylulose 5-phosphate is_a: CHEBI:27354 ! xylulose 5-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16594 name: 2,4-diaminopentanoate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:16595 name: 1D-myo-inositol 1,4,5-trisphosphate is_a: CHEBI:25450 ! myo-inositol trisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16596 name: cyanidin 3-O-rutinoside 5-O-beta-D-glucoside is_a: CHEBI:140278 ! 5-hydroxyanthocyanin O-beta-D-glucoside is_a: CHEBI:26587 ! rutinoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:16597 name: glycerol 1,2-cyclic phosphate is_a: CHEBI:26707 ! glycerol phosphate [Term] id: CHEBI:16598 name: DDE subset: chebi_ph7_3 is_a: CHEBI:23155 ! chlorophenylethylene is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:16599 name: 1,2-diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol is_a: CHEBI:63425 ! galactosylglycerol derivative [Term] id: CHEBI:166 name: (+)-isodihydrocarvone subset: chebi_ph7_3 is_a: CHEBI:23733 ! dihydrocarvone [Term] id: CHEBI:16600 name: mesaconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16602 name: trichloroethene subset: chebi_ph7_3 is_a: CHEBI:23142 ! chloroethenes relationship: has_role CHEBI:38870 ! inhalation anaesthetic relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16603 name: DIMBOA glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23445 ! cyclic hydroxamic acid is_a: CHEBI:46969 ! benzoxazine relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16605 name: allyl alcohol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:26300 ! propenol relationship: has_role CHEBI:24127 ! fungicide relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16606 name: N-benzoyl-4-hydroxyanthranilic acid is_a: CHEBI:48470 ! amidobenzoic acid [Term] id: CHEBI:16607 name: 4-aminoimidazole subset: chebi_ph7_3 is_a: CHEBI:22512 ! aminoimidazole [Term] id: CHEBI:16608 name: 5alpha-cholest-8-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16609 name: 2-dehydro-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:55396 ! 2-dehydropyranose [Term] id: CHEBI:16610 name: spermidine is_a: CHEBI:38751 ! triamine is_a: CHEBI:39474 ! polyazaalkane relationship: has_role CHEBI:138880 ! autophagy inducer relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16613 name: glutathionylspermidine is_a: CHEBI:24337 ! glutathione derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16615 name: biotin amide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:51570 ! biotins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16616 name: 2-methylpropanal O-methyloxime subset: chebi_ph7_3 is_a: CHEBI:36816 ! oxime O-ether [Term] id: CHEBI:16617 name: 1-acylglycerophosphoinositol is_a: CHEBI:36315 ! glycerophosphoinositol [Term] id: CHEBI:16618 name: 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate is_a: CHEBI:60169 ! phosphatidylinositol trisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16619 name: (2-trans,6-trans)-farnesol subset: chebi_ph7_3 is_a: CHEBI:28600 ! farnesol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16620 name: dTDP-4-dehydro-6-deoxy-D-galactose is_a: CHEBI:22080 ! TDP-sugar [Term] id: CHEBI:16621 name: N-phosphotaurocyamine is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:16622 name: 3-dehydro-2-deoxy-D-gluconic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:16624 name: Leu-tRNA(Leu) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16625 name: methylmalonyl-CoA is_a: CHEBI:25136 ! malonyl-CoAs relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16628 name: methylguanidine is_a: CHEBI:24436 ! guanidines relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor relationship: has_role CHEBI:64584 ! uremic toxin [Term] id: CHEBI:16629 name: 4-amino-2-methyl-5-diphosphooxymethylpyrimidine is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:46731 ! alkyl diphosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16630 name: 3-dehydroshikimate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16631 name: vitexin 2''-O-beta-D-glucoside is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:16632 name: vanillate subset: chebi_ph7_3 is_a: CHEBI:25236 ! methoxybenzoate is_a: CHEBI:25388 ! monohydroxybenzoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16633 name: L-selenocysteine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid is_a: CHEBI:83943 ! L-alanine derivative is_a: CHEBI:9093 ! selenocysteine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16634 name: raffinose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide is_a: CHEBI:74961 ! raffinose family oligosaccharide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16635 name: Met-tRNA(Met) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16638 name: 3-methylbutanal subset: chebi_ph7_3 is_a: CHEBI:25282 ! methylbutanal relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16639 name: 4-methoxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25236 ! methoxybenzoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16641 name: ethyl (R)-3-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:23997 ! ethyl 3-hydroxyhexanoate [Term] id: CHEBI:16643 name: L-methionine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:16811 ! methionine is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:74529 ! antidote to paracetamol poisoning relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16645 name: preuroporphyrinogen is_a: CHEBI:22866 ! bilanes relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16646 name: carbohydrate is_a: CHEBI:78616 ! carbohydrates and carbohydrate derivatives [Term] id: CHEBI:16647 name: L-fuculose 1-phosphate is_a: CHEBI:24964 ! deoxyketohexose phosphate [Term] id: CHEBI:16648 name: dialkyl phosphate is_a: CHEBI:22324 ! alkyl phosphate [Term] id: CHEBI:16650 name: UDP-N-acetyl-D-galactosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:16651 name: (S)-lactate subset: chebi_ph7_3 is_a: CHEBI:24996 ! lactate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16652 name: 1,4-diguanidinobutane is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:16653 name: cycloeucalenol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:16654 name: (R)-4-dehydropantoic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:16655 name: N-acetyl-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-D-galactosamine is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22484 ! galactosamine oligosaccharide [Term] id: CHEBI:16656 name: tropinone is_a: CHEBI:37332 ! tropane alkaloid [Term] id: CHEBI:16658 name: flavonol 3-O-[beta-D-xylosyl-(1->2)-beta-D-glycoside]s subset: chebi_ph7_3 is_a: CHEBI:19946 ! xylosylglycoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:16659 name: D-glycerate subset: chebi_ph7_3 is_a: CHEBI:33871 ! glycerate relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16660 name: (S)-4-hydroxymandelonitrile subset: chebi_ph7_3 is_a: CHEBI:18115 ! 4-hydroxymandelonitrile [Term] id: CHEBI:16663 name: poly-cis-polyprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:16664 name: albendazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:35683 ! aryl sulfide is_a: CHEBI:87064 ! benzimidazolylcarbamate fungicide relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:60832 ! tubulin modulator relationship: has_role CHEBI:61951 ! microtubule-destabilising agent [Term] id: CHEBI:16666 name: prephenic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16667 name: (4-hydroxyphenyl)acetonitrile subset: chebi_ph7_3 is_a: CHEBI:24730 ! hydroxynitrile relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16668 name: hypotaurine is_a: CHEBI:37794 ! aminosulfinic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16669 name: 5-dehydro-2-deoxy-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:24961 ! ketoaldonate [Term] id: CHEBI:16670 name: peptide is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:50047 ! organic amino compound relationship: has_part CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:16671 name: 4-guanidinobutanal is_a: CHEBI:22939 ! butanals [Term] id: CHEBI:16673 name: protochlorophyllide is_a: CHEBI:26354 ! protochlorophyllides relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:16675 name: quinolinic acid is_a: CHEBI:36112 ! pyridinedicarboxylic acid relationship: has_role CHEBI:64571 ! NMDA receptor agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16680 name: S-adenosyl-L-homocysteine is_a: CHEBI:136505 ! homocysteine derivative is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:22260 ! adenosines is_a: CHEBI:24610 ! homocysteines relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:65064 ! EC 2.1.1.79 (cyclopropane-fatty-acyl-phospholipid synthase) inhibitor relationship: has_role CHEBI:65065 ! EC 2.1.1.72 [site-specific DNA-methyltransferase (adenine-specific)] inhibitor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16681 name: O-sinapoylglucaric acid is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:16682 name: N-acetyl-beta-alanine is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:22823 ! beta-alanine derivative [Term] id: CHEBI:166828 name: saccharolipid is_a: CHEBI:18059 ! lipid [Term] id: CHEBI:166829 name: ochratoxin A(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:16683 name: 2,3,6-trihydroxypyridine subset: chebi_ph7_3 is_a: CHEBI:27120 ! triihydroxypyridine [Term] id: CHEBI:166831 name: copper chelator is_a: CHEBI:38161 ! chelator [Term] id: CHEBI:16684 name: atropine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:17486 ! (S)-atropine relationship: has_part CHEBI:48882 ! (R)-atropine relationship: has_role CHEBI:136860 ! antidote to sarin poisoning relationship: has_role CHEBI:146270 ! oneirogen relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:38070 ! anti-arrhythmia drug relationship: has_role CHEBI:48876 ! muscarinic antagonist relationship: has_role CHEBI:50370 ! parasympatholytic relationship: has_role CHEBI:50513 ! mydriatic agent relationship: has_role CHEBI:60807 ! anaesthesia adjuvant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16685 name: 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid is_a: CHEBI:23793 ! dihydroxypyridine [Term] id: CHEBI:166856 name: hydroxytrimethylaminium is_a: CHEBI:137983 ! methylated tertiary amine is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:166868 name: (5S)-C-methyl-L-argininium residue subset: chebi_ph7_3 is_a: CHEBI:32699 ! argininium residue is_a: CHEBI:33727 ! proteinogenic amino-acid residue cation [Term] id: CHEBI:16688 name: ecdysone subset: chebi_ph7_3 is_a: CHEBI:23897 ! ecdysteroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36859 ! 2beta-hydroxy steroid is_a: CHEBI:36861 ! 14alpha-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36864 ! 25-hydroxy steroid is_a: CHEBI:36883 ! 6-oxo steroid relationship: has_role CHEBI:71212 ! prohormone [Term] id: CHEBI:16689 name: D-apiose subset: chebi_ph7_3 is_a: CHEBI:26938 ! tetrose [Term] id: CHEBI:16690 name: guanosine 3'-diphosphate 5'-triphosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate is_a: CHEBI:37124 ! guanosine bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:166902 name: noradrenaline(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:166903 name: glycosylmonoradylglycerol subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:166904 name: glycosyldiradylglycerol subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:16691 name: dethiobiotin is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:47857 ! ureas is_a: CHEBI:55370 ! imidazolidinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16692 name: diphthamide residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:16693 name: ADP-D-glycero-D-manno-heptose is_a: CHEBI:20847 ! ADP-glycero-D-manno-heptose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16694 name: 5D-(5/6)-2,6-dihydroxy-5-(hydroxymethyl)cyclohex-2-en-1-one subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:16695 name: uridine 5'-monophosphate is_a: CHEBI:27232 ! uridine 5'-phosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16696 name: 3-methylthiopropylamine is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:16697 name: indan-1-ol subset: chebi_ph7_3 is_a: CHEBI:33854 ! aromatic alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:46940 ! indanes relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:16698 name: cyanamide subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:35487 ! EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor [Term] id: CHEBI:166986 name: alkyldiacylglyceride subset: chebi_ph7_3 is_a: CHEBI:24353 ! glycerol ether is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:47778 ! glyceride is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76579 ! triradylglycerol [Term] id: CHEBI:166988 name: glycerophosphoglycerophosphoglycerol is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:16699 name: 2-dehydro-3-deoxy-D-arabinonate subset: chebi_ph7_3 is_a: CHEBI:24961 ! ketoaldonate is_a: CHEBI:33764 ! arabinonates [Term] id: CHEBI:1670 name: 3-ureidoisobutyric acid is_a: CHEBI:49052 ! ureidocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16700 name: indican subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:24821 ! indolyl carbohydrate is_a: CHEBI:72813 ! exopolysaccharide [Term] id: CHEBI:16701 name: nucleoside 5'-phosphate is_a: CHEBI:29075 ! mononucleotide [Term] id: CHEBI:16702 name: N-sulfo-D-glucosamine is_a: CHEBI:21794 ! N-sulfoglucosamine [Term] id: CHEBI:16704 name: uridine subset: chebi_ph7_3 is_a: CHEBI:27242 ! uridines relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:167046 name: mannosyl-alpha-1->6-inositol-1-phospho-N-(2-hydroxyacyl)-phytoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:74994 ! Man-1-6-Ins-1-P-Cer C(1-) [Term] id: CHEBI:167047 name: mannosyl-alpha-1->6-inositol-1-phosphodihydroceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:139065 ! mannosylinositol-1-phosphodihydroceramide(1-) [Term] id: CHEBI:16705 name: 6-aminopenicillanic acid is_a: CHEBI:25865 ! penicillanic acids relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:167055 name: Jasmonate derivatives is_a: CHEBI:36326 ! octadecanoid [Term] id: CHEBI:167056 name: polyprenol diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:26244 ! prenols [Term] id: CHEBI:167057 name: Monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:76529 ! glycerophosphoglycerophosphoglycerol(2-) [Term] id: CHEBI:16706 name: 2-iodophenol subset: chebi_ph7_3 is_a: CHEBI:24863 ! iodophenol is_a: CHEBI:53291 ! 2-halophenol [Term] id: CHEBI:167063 name: (Methylsulfinyl)methanide is_a: CHEBI:22063 ! sulfoxide [Term] id: CHEBI:16708 name: adenine subset: chebi_ph7_3 is_a: CHEBI:20706 ! 6-aminopurines is_a: CHEBI:26386 ! purine nucleobase relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:16709 name: pyridoxine subset: chebi_ph7_3 is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38196 ! hydroxymethylpyridine relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:167094 name: medium-chain 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:167095 name: secondary fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:24026 ! fatty alcohol is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:167097 name: trihexosylceramide sulfate is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:167098 name: N-(fatty acyl)-ethanolamine subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:16710 name: D-ribulose 1,5-bisphosphate is_a: CHEBI:26573 ! ribulose phosphate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:167104 name: seco-cholestane conjugate is_a: CHEBI:136637 ! steroid glucosiduronic acid anion [Term] id: CHEBI:167105 name: cholestane conjugate is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:167106 name: androstane conjugate is_a: CHEBI:50402 ! androstanoid [Term] id: CHEBI:167107 name: estrane conjugate is_a: CHEBI:131635 ! estrane derivative [Term] id: CHEBI:167108 name: pregnane conjugate is_a: CHEBI:131634 ! pregnane derivative [Term] id: CHEBI:167109 name: acyl sugars is_a: CHEBI:166828 ! saccharolipid [Term] id: CHEBI:16711 name: 4-hydroxybut-2-ynal subset: chebi_ph7_3 is_a: CHEBI:51720 ! ynal [Term] id: CHEBI:167114 name: 2-hydroxydicarboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:167115 name: oxidized glycerophosphocholine zwitterion subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:167116 name: oxidized 1-acyl-sn-glycero-3-phosphocholine zwitterion is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:167118 name: oxidized N-(fatty acyl)-ethanolamine subset: chebi_ph7_3 is_a: CHEBI:167098 ! N-(fatty acyl)-ethanolamine is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:167119 name: oxidized 2-acyl-sn-glycero-3-phosphocholine zwitterion subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:16712 name: (S)-3-sulfolactic acid is_a: CHEBI:38023 ! 3-sulfolactic acid [Term] id: CHEBI:167120 name: oxidized 1-O-alkyl-2-acyl-sn-glycero-3-phosphocholine zwitterion subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:167121 name: oxidized 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:16713 name: 2-aminopteridine-4,7-diol subset: chebi_ph7_3 is_a: CHEBI:23792 ! dihydroxypteridine [Term] id: CHEBI:16714 name: codeine is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound relationship: has_role CHEBI:35482 ! opioid analgesic relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:51177 ! antitussive relationship: has_role CHEBI:60606 ! opioid receptor agonist relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:167148 name: 1-linoleoyl-2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:16715 name: 1,5-anhydro-D-fructose subset: chebi_ph7_3 is_a: CHEBI:131907 ! 3-pyrones is_a: CHEBI:22557 ! anhydrohexose is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:27136 ! triol is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:16716 name: benzene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33842 ! aromatic annulene relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:167164 name: mineral nutrient is_a: CHEBI:46662 ! mineral relationship: has_role CHEBI:33284 ! nutrient [Term] id: CHEBI:167166 name: 3-oxocholestane subset: chebi_ph7_3 is_a: CHEBI:131643 ! ketocholestane [Term] id: CHEBI:16717 name: (Z)-but-2-ene-1,2,3-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:167174 name: N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:167175 name: N-[2-(3,4-dihydroxyphenyl)ethyl]-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:167178 name: N-[(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:167179 name: N-[2-(1H-imidazol-4-yl)ethyl]-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:16718 name: (S)-reticuline is_a: CHEBI:26533 ! reticuline relationship: has_role CHEBI:77111 ! EC 2.1.1.116 [3'-hydroxy-N-methyl-(S)-coclaurine 4'-O-methyltransferase] inhibitor [Term] id: CHEBI:167181 name: deoxyribonucleotide-(2'-deoxyribose)-deoxyribonucleotide residue(3-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:167183 name: piscicide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:16719 name: (R)-pantolactone subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16723 name: 4-methylthio-2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:133493 ! omega-(methylthio)-2-oxocarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16724 name: 4-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:136596 ! 4-hydroxy monocarboxylic acid anion is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion relationship: has_role CHEBI:38877 ! intravenous anaesthetic relationship: has_role CHEBI:60807 ! anaesthesia adjuvant [Term] id: CHEBI:16725 name: 2,3-dihydroxy-p-cumic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid [Term] id: CHEBI:16727 name: 3-maleylpyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:47941 ! 4,6-dioxohept-2-enedioate [Term] id: CHEBI:16728 name: 2-acyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:11502 ! 2-acylglycerophosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16729 name: formyl dihydrogen phosphate is_a: CHEBI:16826 ! acyl monophosphate is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:16730 name: chloramphenicol 3-acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:16731 name: (E)-cinnamaldehyde subset: chebi_ph7_3 is_a: CHEBI:142921 ! 3-phenylprop-2-enal is_a: CHEBI:23245 ! cinnamaldehydes relationship: has_role CHEBI:139492 ! sensitiser relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:62871 ! EC 4.3.1.24 (phenylalanine ammonia-lyase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16732 name: CDP-ethanolamine is_a: CHEBI:25604 ! nucleotide-(amino alcohol)s is_a: CHEBI:36711 ! phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:167322 name: N(omega)-(N-acetyl-beta-D-glucosaminyl)-L-arginyl(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:16733 name: D-alpha-amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:16734 name: N-acetyl-D-tryptophan is_a: CHEBI:21501 ! N-acetyl-D-amino acid is_a: CHEBI:47997 ! D-tryptophan derivative [Term] id: CHEBI:16735 name: 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-6-O-sulfo-D-glucopyranose is_a: CHEBI:20361 ! (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfate is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:16737 name: creatinine subset: chebi_ph7_3 is_a: CHEBI:24995 ! lactam is_a: CHEBI:55370 ! imidazolidinone relationship: has_role CHEBI:33295 ! diagnostic agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16738 name: 2,4-dichlorophenol subset: chebi_ph7_3 is_a: CHEBI:23702 ! dichlorophenol [Term] id: CHEBI:16739 name: 2-furoate subset: chebi_ph7_3 is_a: CHEBI:36056 ! furancarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:16740 name: trans-cyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:18887 ! cyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:16741 name: 4-(beta-D-glucosyloxy)benzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:16742 name: orotic acid is_a: CHEBI:26447 ! pyrimidinemonocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16743 name: D-tagatose 1,6-bisphosphate is_a: CHEBI:24970 ! ketohexose bisphosphate is_a: CHEBI:33953 ! tagatose derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16744 name: pregna-4,9(11)-diene-3,20-dione subset: chebi_ph7_3 is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:167445 name: N(omega)-(6-deoxy-alpha-L-mannosyl)-L-arginyl(2+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:167457 name: poly[(R)-3-hydroxyalkanoate] subset: chebi_ph7_3 is_a: CHEBI:60160 ! polyester polymer [Term] id: CHEBI:16746 name: 1,2,3,5-tetrahydroxybenzene subset: chebi_ph7_3 is_a: CHEBI:22706 ! benzenetetrol [Term] id: CHEBI:16747 name: 4-methylene-L-glutamine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:16749 name: 1-phosphatidyl-1D-myo-inositol is_a: CHEBI:28874 ! phosphatidylinositol [Term] id: CHEBI:167497 name: 1-O-(alk-1-enyl)-2-acyl-sn-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:167498 name: 1-(1,2-saturated-acyl)-2-acyl-sn-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:16750 name: guanosine subset: chebi_ph7_3 is_a: CHEBI:142355 ! purines D-ribonucleoside is_a: CHEBI:24458 ! guanosines relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16751 name: inulobiose subset: chebi_ph7_3 is_a: CHEBI:24407 ! glycosyl glycoside relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16752 name: erythro-5-phosphonooxy-L-lysine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:167527 name: cis-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:16753 name: pantetheine subset: chebi_ph7_3 is_a: CHEBI:25845 ! pantetheines is_a: CHEBI:29256 ! thiol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16754 name: 4-carboxymethyl-3-methylbut-2-en-1,4-olide is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid [Term] id: CHEBI:16755 name: chenodeoxycholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:167550 name: dodecene is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:167555 name: 2-dodecene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:167550 ! dodecene relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:167559 name: glycan is_a: CHEBI:78616 ! carbohydrates and carbohydrate derivatives [Term] id: CHEBI:16758 name: 3-dehydrocarnitinium is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16760 name: phenanthrene-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:37453 ! phenanthrenediol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:167604 name: naphthalene-1,8-diol subset: chebi_ph7_3 is_a: CHEBI:38133 ! naphthalenediol relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:167605 name: 1,8-dihydroxynaphthalene-melanin is_a: CHEBI:25179 ! melanins is_a: CHEBI:26188 ! polyketide relationship: has_role CHEBI:72316 ! virulence factor relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:167609 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:16761 name: ADP is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:167612 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)-(ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:167614 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-(2'-O-methyl-ribonucleoside)-(2'-O-methyl-ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:167616 name: 5'-end ribonucleoside 5'-diphosphate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:167617 name: 5'-(5'-triphosphoguanosine)-(ribonucleotide)(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:167618 name: 5'-end ribonucleotide 5'-triphosphate(4-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:16763 name: 2-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:58951 ! short-chain fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:167637 name: mycofactocin is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:16764 name: 2'-deoxy-5-methyl-5'-cytidylic acid is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate [Term] id: CHEBI:16765 name: tryptamine is_a: CHEBI:27162 ! tryptamines is_a: CHEBI:38631 ! aminoalkylindole is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:64365 ! aralkylamino compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16766 name: 4-carboxymethyl-4-methylbut-2-en-1,4-olide is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid [Term] id: CHEBI:16767 name: 3,4-dichloroaniline subset: chebi_ph7_3 is_a: CHEBI:23696 ! dichloroaniline relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:16768 name: mycothiol subset: chebi_ph7_3 is_a: CHEBI:25441 ! mycothiols is_a: CHEBI:29256 ! thiol is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:63247 ! reducing agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16769 name: 2-oxoglutaramate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16770 name: N(5)-(L-1-carboxyethyl)-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:16771 name: adenosine 5'-phosphoramidate is_a: CHEBI:37773 ! organic phosphoramidate relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:16772 name: xylitol 5-phosphate is_a: CHEBI:22295 ! alditol 5-phosphate is_a: CHEBI:27341 ! xylitol phosphate [Term] id: CHEBI:16773 name: trans-2-chloro-4-carboxymethylenebut-2-en-1,4-olide is_a: CHEBI:23140 ! chlorodienelactone is_a: CHEBI:38122 ! 2-chloro-4-carboxymethylenebut-2-en-1,4-olide [Term] id: CHEBI:16774 name: (2-cis,6-trans)-farnesol subset: chebi_ph7_3 is_a: CHEBI:28600 ! farnesol [Term] id: CHEBI:16775 name: 3-aci-nitropropanoic acid is_a: CHEBI:136622 ! aci-nitro compound [Term] id: CHEBI:16776 name: tabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:65323 ! monoterpenoid indole alkaloid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:16777 name: berbamunine is_a: CHEBI:133004 ! bisbenzylisoquinoline alkaloid is_a: CHEBI:24923 ! isoquinolinol is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:16778 name: apigenin 7-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38686 ! dihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug [Term] id: CHEBI:16780 name: N-(6-aminohexanoyl)-6-aminohexanoate is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:16782 name: (S)-2-hydroxyglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:11596 ! 2-hydroxyglutarate(2-) [Term] id: CHEBI:16783 name: 1D-myo-inositol 1,3,4,5-tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16784 name: 6beta-hydroxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:36851 ! 6beta-hydroxy steroid [Term] id: CHEBI:16785 name: diisopropyl hydrogen phosphate is_a: CHEBI:16648 ! dialkyl phosphate [Term] id: CHEBI:16786 name: vestitone subset: chebi_ph7_3 is_a: CHEBI:140183 ! (3R)-2'-hydroxyisoflavanones is_a: CHEBI:72739 ! hydroxyisoflavanone is_a: CHEBI:72740 ! methoxyisoflavanone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:16787 name: 1-phospho-alpha-D-glucuronic acid is_a: CHEBI:33886 ! glucuronic acids is_a: CHEBI:35145 ! D-glucuronic acid 1-phosphate [Term] id: CHEBI:16788 name: CMP-N-acyl-beta-neuraminic acid is_a: CHEBI:20878 ! CMP-sugar [Term] id: CHEBI:167885 name: primary fluorescent dioxobilin-type chlorophyll catabolite(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:167889 name: O13(4)-desmethyl primary fluorescent dioxobilin-type chlorophyll catabolite(2-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:16789 name: aldehydo-D-lyxose subset: chebi_ph7_3 is_a: CHEBI:62318 ! D-lyxose [Term] id: CHEBI:167890 name: glycyl-L-glutamate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:16790 name: 15,16-dihydrobiliverdin is_a: CHEBI:22869 ! bilins [Term] id: CHEBI:16791 name: vinorine subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:16792 name: oxidized Photinus luciferin subset: chebi_ph7_3 is_a: CHEBI:17165 ! Photinus luciferin relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:16793 name: mercury(2+) subset: chebi_ph7_3 is_a: CHEBI:25197 ! mercury cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16794 name: scopolamine subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:36243 ! propanoate ester is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:48876 ! muscarinic antagonist relationship: has_role CHEBI:50513 ! mydriatic agent relationship: has_role CHEBI:50919 ! antiemetic relationship: has_role CHEBI:53784 ! antispasmodic drug relationship: has_role CHEBI:60807 ! anaesthesia adjuvant relationship: has_role CHEBI:60809 ! adjuvant [Term] id: CHEBI:16795 name: L-threo-3-phenylserine is_a: CHEBI:84144 ! L-phenylalanine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16796 name: melatonin subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:27162 ! tryptamines relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:24621 ! hormone relationship: has_role CHEBI:35488 ! central nervous system depressant relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50847 ! immunological adjuvant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16797 name: 1-methylnicotinamide subset: chebi_ph7_3 is_a: CHEBI:50334 ! pyridinium ion relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16799 name: 16alpha-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:36840 ! 16-hydroxy steroid [Term] id: CHEBI:168 name: (-)-dihydrocarvone subset: chebi_ph7_3 is_a: CHEBI:23733 ! dihydrocarvone [Term] id: CHEBI:16802 name: sedoheptulose subset: chebi_ph7_3 is_a: CHEBI:33949 ! ketoheptose [Term] id: CHEBI:16803 name: N-acetylanthranilate subset: chebi_ph7_3 is_a: CHEBI:61666 ! amidobenzoate [Term] id: CHEBI:16804 name: (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:16805 name: [1-(5-phosphoribosyl)imidazol-4-yl]acetic acid is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:16806 name: xanthine-8-carboxylate subset: chebi_ph7_3 is_a: CHEBI:38668 ! purinecarboxylate [Term] id: CHEBI:16807 name: S(6)-acetyldihydrolipoamide subset: chebi_ph7_3 is_a: CHEBI:23750 ! S-substituted dihydrolipoamide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16808 name: 2-dehydro-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:24966 ! keto-D-gluconate is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:16809 name: D-glucose 6-sulfate is_a: CHEBI:24589 ! monosaccharide sulfate [Term] id: CHEBI:16810 name: 2-oxoglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16811 name: methionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16812 name: (S,S)-butane-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:62064 ! butane-2,3-diol [Term] id: CHEBI:16813 name: galactitol subset: chebi_ph7_3 is_a: CHEBI:24583 ! hexitol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16814 name: dehydroepiandrosterone sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:19168 ! 17-oxo steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77194 ! EC 2.7.1.33 (pantothenate kinase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16815 name: enol-phenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:26008 ! phenylpyruvate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:16816 name: flavonol 3-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:16817 name: trans-4-hydroxycyclohexanecarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid [Term] id: CHEBI:16818 name: all-trans-pentaprenyl diphosphate is_a: CHEBI:53048 ! pentaprenyl diphosphate [Term] id: CHEBI:16820 name: N-benzoyl-D-arginine is_a: CHEBI:21681 ! N-benzoyl-D-arginines is_a: CHEBI:22702 ! benzamides [Term] id: CHEBI:16821 name: 4-oxo-L-proline is_a: CHEBI:37011 ! 4-oxoproline is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:16822 name: choline sulfate subset: chebi_ph7_3 is_a: CHEBI:23216 ! choline sulfates is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:16823 name: kanamycin A 3'-phosphate is_a: CHEBI:36974 ! aminoglycoside phosphate [Term] id: CHEBI:16824 name: D-fuconic acid is_a: CHEBI:24116 ! fuconic acid [Term] id: CHEBI:16825 name: (R)-2-methylimino-1-phenylpropan-1-ol subset: chebi_ph7_3 is_a: CHEBI:26279 ! propan-1-ols [Term] id: CHEBI:16826 name: acyl monophosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:16827 name: corticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:24261 ! glucocorticoid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16828 name: L-tryptophan is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:27897 ! tryptophan is_a: CHEBI:73690 ! erythrose 4-phosphate/phosphoenolpyruvate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16829 name: polyneuridine aldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38481 ! alkaloid ester [Term] id: CHEBI:16830 name: methylamine is_a: CHEBI:17062 ! primary aliphatic amine is_a: CHEBI:25274 ! methylamines is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16831 name: 3-hydroxy-3-methylglutaric acid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16832 name: kievitone subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26115 ! phytoalexin relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:16833 name: neurosporene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene relationship: has_part CHEBI:139114 ! carotenoid psi-end derivative [Term] id: CHEBI:16834 name: L-gamma-glutamyl-D-alanine is_a: CHEBI:50621 ! gamma-glutamylalanine [Term] id: CHEBI:16835 name: 3-hexaprenyl-4-hydroxy-5-methoxybenzoic acid is_a: CHEBI:25238 ! methoxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16836 name: 4-nitrophenol is_a: CHEBI:88306 ! 4-nitrophenols relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16837 name: alpha-ribazole 5'-phosphate is_a: CHEBI:23809 ! dimethylbenzimidazole is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:47917 ! 1-ribosylbenzimidazole relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16838 name: polyphosphate subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion [Term] id: CHEBI:168396 name: mycophenolic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:38831 ! 2-benzofurans relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:53746 ! EC 1.1.1.205 (IMP dehydrogenase) inhibitor relationship: has_role CHEBI:76964 ! Penicillium metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:16840 name: 4-CDP-2-C-methyl-D-erythritol 2-phosphate is_a: CHEBI:22294 ! alditol 4-phosphate is_a: CHEBI:26980 ! tetritol phosphate is_a: CHEBI:35240 ! nucleotide-alditol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16841 name: bis(3-aminopropyl)amine is_a: CHEBI:39474 ! polyazaalkane relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16842 name: formaldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:16843 name: cis-1,2-dihydro-3-ethylcatechol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol [Term] id: CHEBI:16844 name: N(3')-acetyl-2-deoxystreptamine antibiotic is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:16845 name: (S)-2,3,4,5-tetrahydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:11408 ! 2,3,4,5-tetrahydrodipicolinate(2-) [Term] id: CHEBI:16846 name: UDP-alpha-D-galactosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:16848 name: coenzyme gamma-F420-2 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:16849 name: D-fructuronate is_a: CHEBI:24112 ! fructuronate [Term] id: CHEBI:16850 name: 1,2-dihydro-alpha-santonin subset: chebi_ph7_3 is_a: CHEBI:39270 ! naphthofuran [Term] id: CHEBI:16851 name: 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate is_a: CHEBI:37328 ! phosphatidylinositol bisphosphate [Term] id: CHEBI:16852 name: L-dopaquinone is_a: CHEBI:132123 ! 1,2-benzoquinones is_a: CHEBI:84144 ! L-phenylalanine derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16853 name: tetrathionic acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:16854 name: 3-fumarylpyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:47941 ! 4,6-dioxohept-2-enedioate [Term] id: CHEBI:16855 name: D-lysine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:25094 ! lysine relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16856 name: glutathione is_a: CHEBI:29256 ! thiol is_a: CHEBI:47923 ! tripeptide is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:85046 ! skin lightening agent [Term] id: CHEBI:16857 name: L-threonine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:26986 ! threonine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16858 name: pantetheine 4'-phosphate is_a: CHEBI:26073 ! phosphopantetheine is_a: CHEBI:29256 ! thiol relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:16859 name: oxaloacetic acid 4-methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:16860 name: 3',4',5,7-tetrahydroxy-3-methoxyflavone is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38684 ! tetrahydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:16861 name: 7''-O-phosphohygromycin B is_a: CHEBI:24753 ! hygromycin is_a: CHEBI:36974 ! aminoglycoside phosphate is_a: CHEBI:71989 ! ortho ester [Term] id: CHEBI:16862 name: nucleoside 5'-diphosphate is_a: CHEBI:25608 ! nucleoside phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16863 name: 6-phospho-D-gluconate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:16864 name: D-ribofuranosyl-ADP is_a: CHEBI:17193 ! ADP-aldose [Term] id: CHEBI:16865 name: gamma-aminobutyric acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33707 ! gamma-amino acid relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16866 name: alizarin subset: chebi_ph7_3 is_a: CHEBI:37484 ! dihydroxyanthraquinone relationship: has_role CHEBI:23240 ! chromophore relationship: has_role CHEBI:37958 ! dye relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16867 name: D-methionine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:16811 ! methionine [Term] id: CHEBI:16869 name: oleandomycin is_a: CHEBI:25661 ! oleandomycins [Term] id: CHEBI:16870 name: choline alfoscerate subset: chebi_ph7_3 is_a: CHEBI:26706 ! sn-glycerol 3-phosphates is_a: CHEBI:36700 ! phosphocholines relationship: has_role CHEBI:50370 ! parasympatholytic relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16871 name: 4-pyridoxolactone subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:38197 ! furopyridine [Term] id: CHEBI:16872 name: N-malonylanthranilate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:16874 name: psychosine is_a: CHEBI:36527 ! glycosylsphingoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16875 name: 5,6-dihydroxyindole-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:23781 ! dihydroxyindole is_a: CHEBI:38609 ! indolecarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16877 name: oxidized Watasenia luciferin is_a: CHEBI:37919 ! aryl sulfate is_a: CHEBI:38314 ! pyrazines relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:16878 name: N-acetyl-L-gamma-glutamyl phosphate is_a: CHEBI:83982 ! L-glutamic acid derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16879 name: diethyl 2-methyl-3-oxosuccinate subset: chebi_ph7_3 is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:51307 ! diester is_a: CHEBI:51848 ! alpha-ketoester is_a: CHEBI:51849 ! beta-ketoester [Term] id: CHEBI:16880 name: L-ribulose subset: chebi_ph7_3 is_a: CHEBI:28721 ! ribulose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16881 name: 1H-indole subset: chebi_ph7_3 is_a: CHEBI:35581 ! indole is_a: CHEBI:38180 ! polycyclic heteroarene relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16885 name: 1-kestose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:16886 name: 2-aminomuconic acid is_a: CHEBI:145326 ! 2,3-dehydroamino acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16887 name: 5-(4-hydroxybut-1-ynyl)-2,2'-bithiophene subset: chebi_ph7_3 is_a: CHEBI:19281 ! 2,2'-bithiophenes is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:16889 name: trans-3-hydroxy-L-proline is_a: CHEBI:20056 ! 3-hydroxy-L-proline relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16890 name: glycerol monophosphate is_a: CHEBI:26707 ! glycerol phosphate [Term] id: CHEBI:16891 name: glyoxylic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16892 name: 4-amino-5-hydroxymethyl-2-methylpyrimidine subset: chebi_ph7_3 is_a: CHEBI:33857 ! aromatic primary alcohol is_a: CHEBI:38338 ! aminopyrimidine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16893 name: sphinganine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16894 name: 3-sulfopyruvic acid is_a: CHEBI:38031 ! carboxyalkanesulfonic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16895 name: S-methyl-5-thio-D-ribose subset: chebi_ph7_3 is_a: CHEBI:26976 ! thioribose relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16897 name: D-erythrose 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:23956 ! erythrose phosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16899 name: D-mannitol subset: chebi_ph7_3 is_a: CHEBI:29864 ! mannitol relationship: has_role CHEBI:23366 ! compatible osmolytes relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:39456 ! antiglaucoma drug relationship: has_role CHEBI:50504 ! osmotic diuretic relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77965 ! food anticaking agent relationship: has_role CHEBI:77966 ! food stabiliser relationship: has_role CHEBI:77969 ! food humectant relationship: has_role CHEBI:77970 ! food thickening agent relationship: has_role CHEBI:78004 ! food bulking agent [Term] id: CHEBI:16900 name: chlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:16901 name: alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1,3-N-acetyl-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:16903 name: 1-O-(alk-1-enyl)-2-O-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:76583 ! alk-1-enylacylglycerol [Term] id: CHEBI:16904 name: fluoren-9-ol subset: chebi_ph7_3 is_a: CHEBI:24699 ! hydroxyfluorenes is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:16905 name: keto-D-fructose 1,6-bisphosphate is_a: CHEBI:78682 ! D-fructose 1,6-bisphosphate relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16907 name: 4-nitroquinoline N-oxide subset: chebi_ph7_3 is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:35716 ! C-nitro compound relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:16908 name: NADH is_a: CHEBI:13389 ! NAD is_a: CHEBI:13392 ! NAD(P)H relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16910 name: mandelonitrile subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin [Term] id: CHEBI:16912 name: trans-1,2-dithiane-4,5-diol is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:51652 ! dithianes relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16913 name: N-methylphenylethanolamine is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:25990 ! phenylethanolamines relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16914 name: salicylic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:50176 ! keratolytic drug relationship: has_role CHEBI:73181 ! EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16916 name: oligosaccharide phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:16918 name: gallate subset: chebi_ph7_3 is_a: CHEBI:36085 ! trihydroxybenzoate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16919 name: creatine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:24436 ! guanidines relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16923 name: N-formyl-L-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:16924 name: 5-oxo-D-proline is_a: CHEBI:16010 ! 5-oxoproline is_a: CHEBI:84185 ! D-proline derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:16925 name: 6-phospho-5-dehydro-2-deoxy-D-gluconic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:16927 name: L-saccharopine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83229 ! amino acid opine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16929 name: sn-glycero-3-phosphoethanolamine is_a: CHEBI:52330 ! glycerophosphatidylethanolamine [Term] id: CHEBI:16931 name: trans-cyclohexane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:24567 ! cyclohexane-1,2-diol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:16932 name: UDP-N-acetylmuramoyl-L-alanine is_a: CHEBI:35258 ! glyco-amino acid [Term] id: CHEBI:16933 name: ergosterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50403 ! ergostanoid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:16934 name: 3-cyano-L-alanine is_a: CHEBI:60974 ! cyanoamino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16935 name: L-rhamnofuranose subset: chebi_ph7_3 is_a: CHEBI:62345 ! L-rhamnose [Term] id: CHEBI:16937 name: 5,6-dihydroxy-3-methylquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:26507 ! dihydroxyquinoline [Term] id: CHEBI:16938 name: 6-O-phosphono-D-glucono-1,5-lactone is_a: CHEBI:37429 ! aldonolactone phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16939 name: 3-amino-3-(4-hydroxyphenyl)propanoic acid is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:16941 name: cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene subset: chebi_ph7_3 is_a: CHEBI:23684 ! dibenzothiophenes [Term] id: CHEBI:16942 name: lipid X is_a: CHEBI:21635 ! N-acyl-D-glucosamine 1-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16943 name: (R)-2,4-dihydroxy-3-oxobutanoic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:16944 name: L-2-amino-3-oxobutanoate is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:16945 name: scytalone subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:55380 ! beta-hydroxy ketone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:16946 name: L-kynurenine is_a: CHEBI:28683 ! kynurenine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16947 name: citrate(3-) subset: chebi_ph7_3 is_a: CHEBI:133748 ! citrate anion is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16948 name: N-acetyl-D-glucosaminic acid is_a: CHEBI:33772 ! gluconic acid derivative [Term] id: CHEBI:16950 name: 2-dehydro-3-deoxy-L-fuconic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:16952 name: 5-hydroxymethyldeoxycytidylic acid is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate [Term] id: CHEBI:16953 name: N-acetyl-L-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:16954 name: vitexin is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16955 name: GDP-4-dehydro-6-deoxy-alpha-D-mannose is_a: CHEBI:21169 ! GDP-sugar relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16957 name: deacetoxyvindoline is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27288 ! vinca alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:16958 name: beta-alanine is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35222 ! inhibitor relationship: has_role CHEBI:48705 ! agonist relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16959 name: albendazole S-oxide subset: chebi_ph7_3 is_a: CHEBI:22063 ! sulfoxide [Term] id: CHEBI:16960 name: ADP-D-ribose is_a: CHEBI:35239 ! ADP-sugar relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16961 name: monoacylglycerol phosphate is_a: CHEBI:26707 ! glycerol phosphate is_a: CHEBI:37739 ! glycerophospholipid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16962 name: cortisone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:24261 ! glucocorticoid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16964 name: 5-hydroxymethyluracil subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16965 name: 2,3-dihydrogossypetin subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:38744 ! hexahydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones is_a: CHEBI:48039 ! dihydroflavonols [Term] id: CHEBI:16966 name: heteroglycan is_a: CHEBI:18154 ! polysaccharide [Term] id: CHEBI:16967 name: (Z)-5-oxohex-2-enedioate subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:16968 name: 1,8-diazacyclotetradecane-2,9-dione subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:16970 name: UDP-N-acetylmuramoyl-L-alanyl-D-glutamic acid is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:16971 name: benzene-1,2,4-triol subset: chebi_ph7_3 is_a: CHEBI:22707 ! benzenetriol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16973 name: 11-deoxycorticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:25354 ! mineralocorticoid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16974 name: imidazol-4-ylacetic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16975 name: 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:17088 ! monoacyl-sn-glycerol 3-phosphate is_a: CHEBI:76629 ! 2-lysophosphatidic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16976 name: hygromycin B is_a: CHEBI:24753 ! hygromycin is_a: CHEBI:71989 ! ortho ester relationship: has_role CHEBI:35443 ! anthelminthic drug [Term] id: CHEBI:16977 name: L-alanine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:16449 ! alanine is_a: CHEBI:26463 ! pyruvate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:77881 ! EC 4.3.1.15 (diaminopropionate ammonia-lyase) inhibitor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16978 name: leukotriene C4 is_a: CHEBI:25029 ! leukotriene relationship: has_role CHEBI:50141 ! bronchoconstrictor agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16980 name: geranial subset: chebi_ph7_3 is_a: CHEBI:137934 ! polyprenal is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:16981 name: O-(3-O-D-galactosyl-N-acetyl-beta-D-galactosaminyl)-L-serine is_a: CHEBI:21957 ! O-glycosyl-L-serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:16982 name: (R,R)-butane-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:62064 ! butane-2,3-diol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:16984 name: N-acetylimidazole subset: chebi_ph7_3 is_a: CHEBI:38308 ! N-acylimidazole [Term] id: CHEBI:16985 name: 5beta-androstane-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:22542 ! androstane-3,17-dione relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:16987 name: 1-piperideine-6-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16988 name: D-ribose is_a: CHEBI:33942 ! ribose relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:16989 name: 2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid is_a: CHEBI:36055 ! furoic acid [Term] id: CHEBI:16990 name: bilirubin IXalpha is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:36735 ! biladienes relationship: has_part CHEBI:142163 ! 24G7 epitope relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16991 name: deoxyribonucleic acid is_a: CHEBI:33696 ! nucleic acid relationship: has_part CHEBI:33793 ! canonical deoxyribonucleoside residue relationship: has_part CHEBI:50298 ! canonical deoxyribonucleotide residue relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:16992 name: 2-hydroxy-3-oxopropanoic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16993 name: 2-(carboxymethyl)-5-oxo-2,5-dihydro-2-furoic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid is_a: CHEBI:36055 ! furoic acid [Term] id: CHEBI:16994 name: 1-(beta-D-galactosyl)-2-(2-hydroxyacyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:18390 ! N-acyl-beta-D-galactosylsphingosine [Term] id: CHEBI:169942 name: kaempferol 3-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:16816 ! flavonol 3-O-beta-D-glucoside [Term] id: CHEBI:169944 name: kaempferol 7-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:52144 ! flavonol 7-O-beta-D-glucoside [Term] id: CHEBI:16995 name: oxalic acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:16996 name: L-histidinol phosphate is_a: CHEBI:36711 ! phosphoethanolamine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:16997 name: propane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:26284 ! propane-1,2-diols relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:169970 name: 2-hydroxy-ATP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) [Term] id: CHEBI:169971 name: 2-hydroxy-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) [Term] id: CHEBI:169974 name: O(6)-methyl-dGTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) [Term] id: CHEBI:169975 name: O(6)-methyl-dGMP(2-) subset: chebi_ph7_3 is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) [Term] id: CHEBI:169979 name: (+)-trans-isopiperitenol subset: chebi_ph7_3 is_a: CHEBI:24911 ! isopiperitenol [Term] id: CHEBI:16998 name: D-phenylalanine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:28044 ! phenylalanine [Term] id: CHEBI:16999 name: 1-acyl-2-[(S)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:17000 name: tropate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17001 name: 7,8-dihydroneopterin subset: chebi_ph7_3 is_a: CHEBI:25500 ! neopterins is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:170010 name: EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor is_a: CHEBI:38234 ! DNA polymerase inhibitor [Term] id: CHEBI:17002 name: cholesteryl ester subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:17006 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:22788 ! beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-D-glucosylceramide is_a: CHEBI:23075 ! glycotetraosylceramide is_a: CHEBI:90376 ! beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17007 name: 1-(3,4-dimethoxyphenyl)ethane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23976 ! ethanediol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:17008 name: N(2)-acyl-L-glutamine is_a: CHEBI:21644 ! N-acyl-L-amino acid is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:83985 ! N(2)-acylglutamine [Term] id: CHEBI:17009 name: GDP-L-fucose is_a: CHEBI:64608 ! GDP-fucose [Term] id: CHEBI:17010 name: S-inosyl-L-homocysteine is_a: CHEBI:24610 ! homocysteines [Term] id: CHEBI:17011 name: 5-dehydro-D-fructose subset: chebi_ph7_3 is_a: CHEBI:18133 ! hexose [Term] id: CHEBI:17012 name: N-acetylneuraminic acid is_a: CHEBI:21622 ! N-acetylneuraminic acids relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:52425 ! EC 3.2.1.18 (exo-alpha-sialidase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17013 name: dTMP is_a: CHEBI:15245 ! thymidine 5'-monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17015 name: riboflavin is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:30527 ! flavin relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77182 ! food colouring relationship: has_role CHEBI:78675 ! fundamental metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:17016 name: L-methionine S-oxide is_a: CHEBI:49033 ! methionine S-oxide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17019 name: (R)-amygdalin subset: chebi_ph7_3 is_a: CHEBI:27613 ! amygdalin relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17020 name: glucomannan is_a: CHEBI:61298 ! D-glucose- and/or D-galactose-substituted mannan relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:17021 name: S-substituted glutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:17023 name: 2-hydroxyadipic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:17025 name: (S)-dihydroorotic acid is_a: CHEBI:30865 ! dihydroorotic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17026 name: progesterone subset: chebi_ph7_3 is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:64600 ! C21-steroid hormone relationship: has_role CHEBI:49323 ! contraceptive drug relationship: has_role CHEBI:59826 ! progestin relationship: has_role CHEBI:70709 ! progesterone receptor agonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17027 name: allysine is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:17028 name: 2-dehydro-3-deoxy-D-galactonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17029 name: chitin subset: chebi_ph7_3 is_a: CHEBI:21638 ! N-acylglucosamine is_a: CHEBI:22506 ! aminoglycan relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17030 name: cycloartenol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17031 name: chelirubine subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:38517 ! benzophenanthridine alkaloid [Term] id: CHEBI:17032 name: 2-dehydro-3-deoxy-D-gluconic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17033 name: biliverdin is_a: CHEBI:22869 ! bilins relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17034 name: octadecanal subset: chebi_ph7_3 is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:17036 name: dibenzo[1,4]dioxine-2,3-dione subset: chebi_ph7_3 is_a: CHEBI:23825 ! dibenzodioxine is_a: CHEBI:25622 ! orthoquinones [Term] id: CHEBI:17037 name: (19E)-geissoschizine subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:33823 ! enol is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17038 name: fecosterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17039 name: D-glucurono-6,2-lactone subset: chebi_ph7_3 is_a: CHEBI:24301 ! glucuronolactone [Term] id: CHEBI:17040 name: (carboxymethoxy)succinic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:17041 name: (S)-N-methylcoclaurine is_a: CHEBI:38818 ! N-methylcoclaurine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17042 name: tetrachlorohydroquinone is_a: CHEBI:23147 ! chlorohydroquinones is_a: CHEBI:26888 ! tetrachlorobenzene [Term] id: CHEBI:17043 name: biphenyl-2-ol subset: chebi_ph7_3 is_a: CHEBI:24681 ! hydroxybiphenyls relationship: has_role CHEBI:78299 ! environmental food contaminant relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:17044 name: D-glucitol 6-phosphate is_a: CHEBI:26725 ! glucitol phosphate is_a: CHEBI:35375 ! alditol 6-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17045 name: dinitrogen oxide subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:35196 ! nitrogen oxide relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:38869 ! general anaesthetic relationship: has_role CHEBI:38870 ! inhalation anaesthetic relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:76413 ! greenhouse gas relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77971 ! raising agent relationship: has_role CHEBI:77974 ! food packaging gas relationship: has_role CHEBI:78017 ! food propellant relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:17047 name: all-trans-undecaprenyl diphosphate is_a: CHEBI:27193 ! undecaprenyl phosphate is_a: CHEBI:53042 ! undecaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate [Term] id: CHEBI:17048 name: nororientaline is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:24922 ! isoquinolines is_a: CHEBI:24923 ! isoquinolinol [Term] id: CHEBI:17049 name: 6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol is_a: CHEBI:24275 ! glucosaminylphosphatidylinositol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17050 name: 3-phosphoglyceric acid is_a: CHEBI:25405 ! monophosphoglyceric acid is_a: CHEBI:63455 ! tetronic acid derivative relationship: has_role CHEBI:78675 ! fundamental metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17051 name: fluoride subset: chebi_ph7_3 is_a: CHEBI:16042 ! halide anion is_a: CHEBI:36895 ! monoatomic fluorine [Term] id: CHEBI:17052 name: 3-phosphoshikimic acid is_a: CHEBI:37412 ! phosphoshikimic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17053 name: L-aspartic acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:22660 ! aspartic acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17056 name: 1-carboxyvinyl carboxyphosphonate is_a: CHEBI:37592 ! organic phosphonate is_a: CHEBI:37735 ! phosphonic ester [Term] id: CHEBI:17057 name: cellobiose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17058 name: 3-dehydroecdysone subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:17059 name: 2-methylcholine subset: chebi_ph7_3 is_a: CHEBI:23217 ! cholines [Term] id: CHEBI:17061 name: D-glutamine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:28300 ! glutamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17062 name: primary aliphatic amine is_a: CHEBI:32877 ! primary amine [Term] id: CHEBI:17063 name: L-erythrulose 1-phosphate is_a: CHEBI:14216 ! erythrulose 1-phosphate [Term] id: CHEBI:17064 name: 4-nitroaniline subset: chebi_ph7_3 is_a: CHEBI:25550 ! nitroaniline relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:17065 name: 3',5'-cyclic CMP is_a: CHEBI:19835 ! 3',5'-cyclic pyrimidine nucleotide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17066 name: (R)-3-hydroxybutyric acid is_a: CHEBI:20067 ! 3-hydroxybutyric acid is_a: CHEBI:73693 ! ketone body relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17068 name: 3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoyl-CoA is_a: CHEBI:20081 ! 3-hydroxypropionyl-CoA [Term] id: CHEBI:17069 name: 3-hydroxybenzyl alcohol subset: chebi_ph7_3 is_a: CHEBI:24679 ! hydroxybenzyl alcohol is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17071 name: glycolaldehyde subset: chebi_ph7_3 is_a: CHEBI:24387 ! glycolaldehydes relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17072 name: N-amidino-L-aspartic acid is_a: CHEBI:83978 ! L-aspartic acid derivative is_a: CHEBI:90143 ! N-amidinoaspartic acid [Term] id: CHEBI:17073 name: Cypridina luciferin is_a: CHEBI:24436 ! guanidines is_a: CHEBI:24828 ! indoles is_a: CHEBI:37847 ! imidazopyrazine relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:17074 name: cycasin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:17075 name: 6-hydroxyhexano-6-lactone subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:17076 name: streptomycin is_a: CHEBI:26788 ! streptomycins is_a: CHEBI:87113 ! antibiotic antifungal drug is_a: CHEBI:87114 ! antibiotic fungicide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:36043 ! antimicrobial drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:17077 name: 2-carboxy-D-arabinitol is_a: CHEBI:33843 ! arabinonic acid derivative [Term] id: CHEBI:17078 name: L-gamma-glutamyl-L-cysteinyl-beta-alanine is_a: CHEBI:24195 ! gamma-glutamylcysteine [Term] id: CHEBI:17079 name: (S)-3'-hydroxy-N-methylcoclaurine is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:24922 ! isoquinolines relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17081 name: dimethylmaleate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:17082 name: L-2-aminoadipate(2-) is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:17083 name: 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-ol subset: chebi_ph7_3 is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17084 name: 2-hydroxyglutaric acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17087 name: ketone subset: chebi_ph7_3 is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:17088 name: monoacyl-sn-glycerol 3-phosphate is_a: CHEBI:16961 ! monoacylglycerol phosphate is_a: CHEBI:26706 ! sn-glycerol 3-phosphates [Term] id: CHEBI:17089 name: glycoprotein is_a: CHEBI:33837 ! conjugated protein is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:17090 name: (1R,2R,3R)-prephytoene diphosphate is_a: CHEBI:14885 ! prephytoene diphosphate [Term] id: CHEBI:17092 name: 3-chloro-D-alanine is_a: CHEBI:83944 ! D-alanine derivative is_a: CHEBI:88164 ! 3-chloroalanine relationship: has_role CHEBI:59647 ! EC 2.3.1.50 (serine C-palmitoyltransferase) inhibitor [Term] id: CHEBI:17094 name: 2-dehydropantoic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:17095 name: cis-1,6-dihydroxy-4-methylcyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid [Term] id: CHEBI:17096 name: strictosidine aglycone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:17097 name: biphenyl subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:87034 ! aromatic fungicide relationship: has_role CHEBI:65256 ! antimicrobial food preservative relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:17098 name: veratraldehyde subset: chebi_ph7_3 is_a: CHEBI:22698 ! benzaldehydes is_a: CHEBI:51681 ! dimethoxybenzene relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:17099 name: aspulvinone H is_a: CHEBI:22669 ! aspulvinone [Term] id: CHEBI:17100 name: L-arabinono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:37422 ! arabinono-1,4-lactone [Term] id: CHEBI:17101 name: macarpine subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:38517 ! benzophenanthridine alkaloid [Term] id: CHEBI:17102 name: phosphoramide is_a: CHEBI:33256 ! primary amide [Term] id: CHEBI:17103 name: N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide(d18:1(4E)) subset: chebi_ph7_3 is_a: CHEBI:142587 ! N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:36508 ! glycotriaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17104 name: 6-hydroxyprotopine subset: chebi_ph7_3 is_a: CHEBI:38608 ! dibenzazecine alkaloid is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:17105 name: 4-maleylacetoacetate subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17106 name: 1-alkyl-sn-glycerol 3-phosphate is_a: CHEBI:22329 ! alkyl-sn-glycerol 3-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17108 name: D-arabinose is_a: CHEBI:22599 ! arabinose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17109 name: 7,8-dihydro-7,8-dihydroxykynurenic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid [Term] id: CHEBI:17110 name: 1-guanidino-1-deoxy-scyllo-inositol is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:17111 name: 5-O-phosphono-alpha-D-ribofuranosyl diphosphate is_a: CHEBI:48956 ! 5-O-phosphono-D-ribofuranosyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17113 name: erythritol subset: chebi_ph7_3 is_a: CHEBI:48299 ! butane-1,2,3,4-tetrol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17114 name: N(5)-formyl-5,6,7,8-tetrahydromethanopterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:17115 name: L-serine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:17822 ! serine is_a: CHEBI:26650 ! serine family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17117 name: 5-dehydro-4-deoxy-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:33903 ! glucuronates [Term] id: CHEBI:17118 name: aldehydo-D-galactose subset: chebi_ph7_3 is_a: CHEBI:12936 ! D-galactose is_a: CHEBI:37662 ! aldehydo-galactose [Term] id: CHEBI:17119 name: fMet-tRNA(fMet) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17120 name: hexanoate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78116 ! fatty acid anion 6:0 relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17121 name: oxomalonate(2-) subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:17122 name: aldehydo-N-acetyl-D-mannosamine subset: chebi_ph7_3 is_a: CHEBI:62164 ! N-acetylmannosamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17123 name: 2-aminoacrylic acid is_a: CHEBI:145326 ! 2,3-dehydroamino acid is_a: CHEBI:47989 ! enamine is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17125 name: 6-acetamido-3-aminohexanoate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:17126 name: carnitine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17127 name: glucotropeolin is_a: CHEBI:22712 ! benzenes is_a: CHEBI:79342 ! aralkylglucosinolic acid [Term] id: CHEBI:17128 name: adipate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17129 name: (S)-scoulerine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:50276 ! EC 5.99.1.2 (DNA topoisomerase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17130 name: 10-oxocapric acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:17131 name: (3,5-diiodo-4-hydroxyphenyl)pyruvic acid is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:17132 name: diethyl (2R,3R)-2-hydroxy-3-methylsuccinate subset: chebi_ph7_3 is_a: CHEBI:23711 ! diethyl 2-methyl-3-hydroxysuccinate [Term] id: CHEBI:17133 name: deoxylimonoic acid is_a: CHEBI:24129 ! furans is_a: CHEBI:25000 ! lactone is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:39434 ! limonoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17134 name: octopamine is_a: CHEBI:25990 ! phenylethanolamines is_a: CHEBI:27175 ! tyramines relationship: has_role CHEBI:25512 ! neurotransmitter [Term] id: CHEBI:17135 name: long-chain fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:24026 ! fatty alcohol [Term] id: CHEBI:17136 name: 2,8-dihydroxy-1,4-naphthoquinone is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone [Term] id: CHEBI:17137 name: hydrogensulfite is_a: CHEBI:33482 ! sulfur oxoanion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17138 name: glyceraldehyde 3-phosphate is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35142 ! aldotriose phosphate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17139 name: 6-O-sulfo-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->3)-1-O-alkyl-2-O-acylglycerol is_a: CHEBI:37909 ! oligosaccharide sulfate [Term] id: CHEBI:17140 name: D-xylulose subset: chebi_ph7_3 is_a: CHEBI:27353 ! xylulose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17141 name: cysteamine is_a: CHEBI:29256 ! thiol is_a: CHEBI:32952 ! amine relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17142 name: 5-formyl-2-hydroxyhepta-2,4-dienedioic acid is_a: CHEBI:38436 ! muconic semialdehyde [Term] id: CHEBI:17143 name: 5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:26507 ! dihydroxyquinoline [Term] id: CHEBI:17144 name: 2-(3-amino-3-carboxypropyl)-L-histidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17146 name: anhydrotetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:17147 name: 5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one subset: chebi_ph7_3 is_a: CHEBI:26414 ! pyridazinone is_a: CHEBI:33853 ! phenols is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:17148 name: putrescine is_a: CHEBI:35411 ! alkane-alpha,omega-diamine relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17149 name: N-acetyl-beta-D-glycosaminyl glycopeptide is_a: CHEBI:24396 ! glycopeptide [Term] id: CHEBI:17150 name: 2-phosphoglycolic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17151 name: xylitol subset: chebi_ph7_3 is_a: CHEBI:25899 ! pentitol relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17152 name: phosphatidyl-N,N-dimethylethanolamine is_a: CHEBI:16038 ! phosphatidylethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17153 name: propanal subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17154 name: nicotinamide subset: chebi_ph7_3 is_a: CHEBI:176839 ! vitamin B3 is_a: CHEBI:25529 ! pyridinecarboxamide is_a: CHEBI:26416 ! pyridine alkaloid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:62913 ! EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:71181 ! Sir2 inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:17155 name: flavonol 3-O-(6-O-malonyl-beta-D-glucoside) is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17156 name: 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:17157 name: trans,trans-2,3,4,5-tetradehydroacyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:17158 name: methylglyoxal subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:27659 ! 2-oxo aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17159 name: (R)-carnitinamide subset: chebi_ph7_3 is_a: CHEBI:22475 ! amino acid amide is_a: CHEBI:48604 ! carnitinamide [Term] id: CHEBI:17160 name: 17alpha-estradiol subset: chebi_ph7_3 is_a: CHEBI:23965 ! estradiol is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:50114 ! estrogen [Term] id: CHEBI:17161 name: O-demethylpuromycin is_a: CHEBI:26404 ! puromycins [Term] id: CHEBI:17162 name: 2-oxooctadecanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:17163 name: S-methyl D-thioglycerate subset: chebi_ph7_3 is_a: CHEBI:37696 ! carbohydrate acid ester is_a: CHEBI:51277 ! thioester [Term] id: CHEBI:17164 name: stachyose subset: chebi_ph7_3 is_a: CHEBI:50126 ! tetrasaccharide is_a: CHEBI:74961 ! raffinose family oligosaccharide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17165 name: Photinus luciferin is_a: CHEBI:37947 ! benzothiazoles is_a: CHEBI:48652 ! 1,3-thiazolemonocarboxylic acid is_a: CHEBI:83991 ! imidothioate relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:17166 name: N-methylputrescine is_a: CHEBI:26406 ! N-substituted putrescine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:171664 name: antiamoebic agent is_a: CHEBI:35442 ! antiparasitic agent [Term] id: CHEBI:17167 name: (R)-lactaldehyde subset: chebi_ph7_3 is_a: CHEBI:18419 ! lactaldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17168 name: 5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17169 name: benzaldehyde subset: chebi_ph7_3 is_a: CHEBI:22698 ! benzaldehydes relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:62873 ! odorant receptor agonist relationship: has_role CHEBI:65001 ! EC 3.1.1.3 (triacylglycerol lipase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77118 ! EC 3.5.5.1 (nitrilase) inhibitor [Term] id: CHEBI:17170 name: dimethylamine is_a: CHEBI:25274 ! methylamines is_a: CHEBI:50981 ! secondary aliphatic amine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17172 name: 2'-deoxyguanosine subset: chebi_ph7_3 is_a: CHEBI:142361 ! purines 2'-deoxy-D-ribonucleoside is_a: CHEBI:19254 ! purine 2'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17173 name: D-ribulose subset: chebi_ph7_3 is_a: CHEBI:28721 ! ribulose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17174 name: heparosan N-sulfate L-iduronic acid is_a: CHEBI:33897 ! iduronic acids is_a: CHEBI:35721 ! heparan sulfates relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17175 name: guanidinoethyl methyl phosphate is_a: CHEBI:24442 ! guanidinoethyl methyl phosphates [Term] id: CHEBI:17176 name: long-chain fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:17177 name: cinnamyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17179 name: taurolithocholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17180 name: 3-hydroxypyruvate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17181 name: 5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene subset: chebi_ph7_3 is_a: CHEBI:19281 ! 2,2'-bithiophenes [Term] id: CHEBI:17183 name: sanguinarine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid is_a: CHEBI:86322 ! alkaloid antibiotic is_a: CHEBI:86494 ! botanical anti-fungal agent [Term] id: CHEBI:17184 name: chlordecone alcohol subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:17185 name: 2,3,5-trihydroxytoluene subset: chebi_ph7_3 is_a: CHEBI:27119 ! trihydroxytoluene [Term] id: CHEBI:17187 name: pinene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene [Term] id: CHEBI:17188 name: nucleoside 5'-monophosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:17189 name: 2,5-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid relationship: has_role CHEBI:64345 ! MALDI matrix material relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17191 name: L-isoleucine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:24898 ! isoleucine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17192 name: 3,5-dibromo-4-hydroxybenzonitrile is_a: CHEBI:24730 ! hydroxynitrile is_a: CHEBI:33853 ! phenols is_a: CHEBI:37147 ! dibromobenzene relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:17193 name: ADP-aldose is_a: CHEBI:35239 ! ADP-sugar [Term] id: CHEBI:17194 name: bromochloromethane subset: chebi_ph7_3 is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:17195 name: thiomorpholine-3-carboxylic acid is_a: CHEBI:36223 ! thiomorpholinemonocarboxylic acid [Term] id: CHEBI:17196 name: L-asparagine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:22653 ! asparagine is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17197 name: 1-alkylglycerone 3-phosphate is_a: CHEBI:22335 ! alkylglycerone phosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17198 name: dolichyl N-acetyl-alpha-D-glucosaminyl phosphate is_a: CHEBI:24274 ! glucosaminylphosphodolichol [Term] id: CHEBI:17199 name: 4,5-dihydroxyphthalic acid is_a: CHEBI:24676 ! hydroxybenzoic acid [Term] id: CHEBI:17200 name: UDP-alpha-D-glucuronic acid is_a: CHEBI:197331 ! UDP-D-glucuronic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17201 name: glycylglycine is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17202 name: IMP is_a: CHEBI:24843 ! inosine phosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17203 name: L-proline is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:24318 ! glutamine family amino acid is_a: CHEBI:26271 ! proline is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:23366 ! compatible osmolytes relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17204 name: 4,5-dioxopentanoic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:17206 name: 9,11alpha-epoxypregn-4-ene-3,20-dione subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:17207 name: 2-methylideneglutaric acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:17209 name: dihydrosanguinarine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:17210 name: (S)-4-hydroxymandelate subset: chebi_ph7_3 is_a: CHEBI:32804 ! 4-hydroxymandelate [Term] id: CHEBI:17211 name: geranyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17212 name: 1,2-dihydroxydibenzothiophene subset: chebi_ph7_3 is_a: CHEBI:23684 ! dibenzothiophenes [Term] id: CHEBI:17213 name: D-lysopine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83229 ! amino acid opine [Term] id: CHEBI:17214 name: (2S)-2-isopropyl-3-oxosuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17215 name: methyl L-tyrosinate subset: chebi_ph7_3 is_a: CHEBI:21415 ! L-tyrosyl ester is_a: CHEBI:25248 ! methyl ester [Term] id: CHEBI:17216 name: oxidized Cypridina luciferin is_a: CHEBI:17073 ! Cypridina luciferin is_a: CHEBI:24436 ! guanidines is_a: CHEBI:38314 ! pyrazines relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:17217 name: 2-butenoic acid is_a: CHEBI:22959 ! butenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:17219 name: limonene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:25040 ! limonene monoterpenoid [Term] id: CHEBI:1722 name: 3beta-hydroxy-Delta(5)-steroid subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:17221 name: beta-myrcene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:36413 ! anabolic agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17223 name: polyprenyl glucosyl phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:17224 name: 4-methylumbelliferone subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:131561 ! hyaluronic acid synthesis inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:17225 name: salutaridine is_a: CHEBI:25418 ! morphinane alkaloid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:64951 ! anti-HBV agent [Term] id: CHEBI:17226 name: rosmarinic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33308 ! carboxylic ester relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:48353 ! serine proteinase inhibitor relationship: has_role CHEBI:48550 ! EC 1.1.1.21 (aldehyde reductase) inhibitor relationship: has_role CHEBI:49110 ! peripheral nervous system drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17228 name: taurocyamine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:33551 ! organosulfonic acid [Term] id: CHEBI:17229 name: 5-(3-hydroxy-4-acetoxybut-1-ynyl)-2,2'-bithiophene subset: chebi_ph7_3 is_a: CHEBI:19281 ! 2,2'-bithiophenes is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:17230 name: homocysteine is_a: CHEBI:24610 ! homocysteines is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17231 name: m-cresol subset: chebi_ph7_3 is_a: CHEBI:25399 ! cresol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17232 name: L-glutamic 5-semialdehyde is_a: CHEBI:24313 ! glutamic semialdehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17233 name: (3Z,5S)-3-(1-hydroxyethylidene)-5-\{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione is_a: CHEBI:22838 ! beta-cyclopiazonic acid [Term] id: CHEBI:17234 name: glucose is_a: CHEBI:33917 ! aldohexose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17236 name: 2-hydroxy-6-oxohexa-2,4-dienoic acid is_a: CHEBI:38436 ! muconic semialdehyde is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:172368 name: brominated flame retardant is_a: CHEBI:37141 ! organobromine compound relationship: has_role CHEBI:77853 ! persistent organic pollutant relationship: has_role CHEBI:79314 ! flame retardant [Term] id: CHEBI:17237 name: (E)-4-(trimethylammonio)but-2-enoate subset: chebi_ph7_3 is_a: CHEBI:11946 ! 4-(trimethylammonio)but-2-enoate [Term] id: CHEBI:17239 name: CDP is_a: CHEBI:23521 ! cytidine 5'-phosphate is_a: CHEBI:37039 ! pyrimidine ribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17240 name: itaconate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17241 name: 1H-pyrazole subset: chebi_ph7_3 is_a: CHEBI:14973 ! pyrazole [Term] id: CHEBI:17242 name: dehydroascorbic acid is_a: CHEBI:47016 ! tetrahydrofuranone relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17243 name: mono(2-ethylhexyl) phthalate is_a: CHEBI:132610 ! phthalic acid monoester [Term] id: CHEBI:17244 name: 5,6-dihydroquinoline-2,5,6-triol subset: chebi_ph7_3 is_a: CHEBI:38774 ! hydroxyquinoline [Term] id: CHEBI:17245 name: carbon monoxide subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:23014 ! carbon oxide is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:25355 ! mitochondrial respiratory-chain inhibitor relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:38500 ! EC 1.9.3.1 (cytochrome c oxidase) inhibitor relationship: has_role CHEBI:50183 ! P450 inhibitor relationship: has_role CHEBI:50406 ! probe relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:52214 ! ligand relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17246 name: poly(vinyl alcohol) macromolecule subset: chebi_ph7_3 is_a: CHEBI:37997 ! homopolymer macromolecule is_a: CHEBI:53242 ! vinyl polymer macromolecule [Term] id: CHEBI:17247 name: N-isopropylammelide subset: chebi_ph7_3 is_a: CHEBI:38169 ! monoamino-1,3,5-triazine is_a: CHEBI:38173 ! dihydroxy-1,3,5-triazine [Term] id: CHEBI:17248 name: 6-lactoyl-5,6,7,8-tetrahydropterin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:30436 ! tetrahydropterin is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17249 name: D-nopaline is_a: CHEBI:24436 ! guanidines is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83229 ! amino acid opine is_a: CHEBI:83965 ! L-arginine derivative is_a: CHEBI:83983 ! D-glutamic acid derivative [Term] id: CHEBI:17250 name: 2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:17251 name: pentalenene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:37089 ! ortho-fused tricyclic hydrocarbon [Term] id: CHEBI:17252 name: 17alpha-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:138141 ! 17alpha-hydroxy-C21-steroid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:59826 ! progestin relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17253 name: 1,2-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:132123 ! 1,2-benzoquinones is_a: CHEBI:39439 ! benzoquinone [Term] id: CHEBI:17254 name: 4-methylcatechol subset: chebi_ph7_3 is_a: CHEBI:25289 ! methylcatechol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17255 name: N-carbamoyl-D-alpha-amino acid is_a: CHEBI:21689 ! N-carbamoyl-amino acid [Term] id: CHEBI:17256 name: 2'-deoxyadenosine subset: chebi_ph7_3 is_a: CHEBI:142361 ! purines 2'-deoxy-D-ribonucleoside is_a: CHEBI:19254 ! purine 2'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17257 name: bis-gamma-glutamylcystine is_a: CHEBI:24195 ! gamma-glutamylcysteine [Term] id: CHEBI:17258 name: 7H-purine subset: chebi_ph7_3 is_a: CHEBI:35584 ! purine [Term] id: CHEBI:17259 name: CDP-3,6-dideoxy-D-mannose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:17260 name: butanoyl dihydrogen phosphate is_a: CHEBI:16826 ! acyl monophosphate [Term] id: CHEBI:17261 name: N(4)-(beta-N-acetyl-D-glucosaminyl)-L-asparagine is_a: CHEBI:21836 ! N(4)-glycosyl-L-asparagine is_a: CHEBI:24273 ! glucosaminylamine [Term] id: CHEBI:17262 name: dTDP-D-galacturonic acid is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:33808 ! galacturonic acids [Term] id: CHEBI:17263 name: estrone subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17264 name: phosphatidylglycerol phosphate is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:17265 name: O-(1->4)-alpha-L-dihydrostreptosylstreptidine 6-phosphate is_a: CHEBI:26613 ! scyllo-inositol phosphate [Term] id: CHEBI:17266 name: L-sorbose is_a: CHEBI:27922 ! sorbose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17268 name: myo-inositol subset: chebi_ph7_3 is_a: CHEBI:24848 ! inositol relationship: has_role CHEBI:23366 ! compatible osmolytes relationship: has_role CHEBI:33284 ! nutrient relationship: has_role CHEBI:64763 ! EC 3.1.4.11 (phosphoinositide phospholipase C) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17269 name: Latia luciferin subset: chebi_ph7_3 is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:52343 ! formate ester relationship: has_role CHEBI:25078 ! luciferin relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:17270 name: glycerol 2-phosphate is_a: CHEBI:16890 ! glycerol monophosphate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17271 name: 3-phosphonatopyruvate(3-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:17272 name: propionate subset: chebi_ph7_3 is_a: CHEBI:78113 ! fatty acid anion 3:0 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17274 name: aldehydo-N-acyl-D-glucosamine subset: chebi_ph7_3 is_a: CHEBI:21638 ! N-acylglucosamine [Term] id: CHEBI:17275 name: 2-isopropylmaleic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17276 name: phloretin subset: chebi_ph7_3 is_a: CHEBI:71230 ! dihydrochalcones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17277 name: UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:17278 name: 5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol subset: chebi_ph7_3 is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:36852 ! 26-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17279 name: N-succinyl-LL-2,6-diaminopimelic acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17281 name: 2-deoxy-D-ribono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:37434 ! ribonolactone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17282 name: 3-(indol-3-yl)lactate subset: chebi_ph7_3 is_a: CHEBI:58896 ! 2-hydroxy carboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17283 name: 1-phosphatidyl-1D-myo-inositol 3-phosphate is_a: CHEBI:26034 ! phosphatidylinositol 3-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17284 name: 5-phospho-D-ribosylamine is_a: CHEBI:26568 ! ribosylamine is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:17285 name: L-cysteic acid is_a: CHEBI:21260 ! cysteic acid is_a: CHEBI:37793 ! amino sulfonic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17286 name: deacetylisoipecoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:24922 ! isoquinolines is_a: CHEBI:25248 ! methyl ester [Term] id: CHEBI:17287 name: N-phosphocreatine is_a: CHEBI:26051 ! phosphoamino acid is_a: CHEBI:64618 ! phosphagen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:172878 name: 2-oxo-ATP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) [Term] id: CHEBI:172880 name: 5'-(N(2),N(7)-dimethyl 5'-triphosphoguanosine)-ribonucleoside(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:17289 name: homoserine lactone is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:1729 name: 4'-demethyldeoxypodophyllotoxin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:33853 ! phenols is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:50307 ! furonaphthodioxole is_a: CHEBI:51683 ! methoxybenzenes relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17290 name: (S)-3-hydroxybutyric acid is_a: CHEBI:20067 ! 3-hydroxybutyric acid [Term] id: CHEBI:17291 name: L-fuconic acid is_a: CHEBI:24116 ! fuconic acid [Term] id: CHEBI:17292 name: beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:20971 ! D-galactosyl-N-acetyl-D-glucosaminyl-(1->3)-D-galactosyl-(1->4)-D-glucosylceramide is_a: CHEBI:90800 ! beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17293 name: 2-aminophenoxazin-3-one subset: chebi_ph7_3 is_a: CHEBI:25970 ! phenoxazine [Term] id: CHEBI:17294 name: 4,21-dehydrogeissoschizine subset: chebi_ph7_3 is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:17295 name: L-phenylalanine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:28044 ! phenylalanine is_a: CHEBI:73690 ! erythrose 4-phosphate/phosphoenolpyruvate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:63332 ! EC 3.1.3.1 (alkaline phosphatase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17296 name: aniline subset: chebi_ph7_3 is_a: CHEBI:22562 ! anilines is_a: CHEBI:50471 ! primary arylamine [Term] id: CHEBI:17297 name: UDP-sugar is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar [Term] id: CHEBI:17298 name: dolichyl D-xylosyl phosphate is_a: CHEBI:23875 ! dolichol phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:17299 name: 4-methylene-L-glutamate(2-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:17300 name: tetrachloroethene subset: chebi_ph7_3 is_a: CHEBI:23142 ! chloroethenes is_a: CHEBI:39226 ! chlorocarbon relationship: has_role CHEBI:50909 ! nephrotoxic agent [Term] id: CHEBI:17301 name: glucaric acid is_a: CHEBI:24577 ! hexaric acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17302 name: pentadecanal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84587 ! 2,3-saturated fatty aldehyde relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17303 name: morphine is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35482 ! opioid analgesic relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:38867 ! anaesthetic relationship: has_role CHEBI:55322 ! mu-opioid receptor agonist relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:17304 name: piperitenone subset: chebi_ph7_3 is_a: CHEBI:26153 ! p-menthadien-3-one [Term] id: CHEBI:17305 name: 2-dehydro-3-deoxy-D-glucaric acid is_a: CHEBI:33797 ! glucaric acid derivative [Term] id: CHEBI:17306 name: maltose subset: chebi_ph7_3 is_a: CHEBI:17593 ! maltooligosaccharide is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17307 name: dTDP-6-deoxy-L-talose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:17308 name: 2-oxohexanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:173082 name: aceneuramic acid is_a: CHEBI:21622 ! N-acetylneuraminic acids is_a: CHEBI:22160 ! acetamides is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:173083 name: aceneuramate subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:173084 name: ferroptosis inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:173085 name: ferroptosis inducer is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:17309 name: pectin is_a: CHEBI:24174 ! galacturonan relationship: has_role CHEBI:55323 ! antidiarrhoeal drug relationship: has_role CHEBI:63047 ! food emulsifier relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77966 ! food stabiliser relationship: has_role CHEBI:77970 ! food thickening agent relationship: has_role CHEBI:78016 ! food gelling agent [Term] id: CHEBI:17310 name: pyridoxal subset: chebi_ph7_3 is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38187 ! pyridinecarbaldehyde is_a: CHEBI:38196 ! hydroxymethylpyridine relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17311 name: N(6),N(6),N(6)-trimethyl-L-lysine is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:173114 name: tRNA 5'-phosphate polyanion subset: chebi_ph7_3 is_a: CHEBI:140395 ! poly(nucleoside 5'-monophosphate) polyanion [Term] id: CHEBI:173115 name: poly(RNA)-3'-adenine ribonucleotide polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:173116 name: poly(RNA)-3'-uridine ribonucleotide polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:17312 name: N(1)-acetylspermine is_a: CHEBI:22160 ! acetamides is_a: CHEBI:22205 ! acetylspermine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17313 name: 7,8-dihydroxycoumarin subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin [Term] id: CHEBI:17314 name: 13-hydroxydocosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:17315 name: D-glucosamine is_a: CHEBI:5417 ! glucosamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17316 name: 2-N,6-O-disulfo-D-glucosamine is_a: CHEBI:21794 ! N-sulfoglucosamine is_a: CHEBI:37878 ! glucosamine sulfate [Term] id: CHEBI:17317 name: D-sorbose is_a: CHEBI:27922 ! sorbose [Term] id: CHEBI:17318 name: N-(3,4-dichlorophenyl)malonamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:17319 name: 5'-deoxyadenosine subset: chebi_ph7_3 is_a: CHEBI:22260 ! adenosines is_a: CHEBI:36988 ! 5'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17320 name: 23,24-dihydrocucurbitacin is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16219 ! cucurbitacin is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:17321 name: 5,6,7,8-tetrahydromethanopterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:17322 name: chloric acid is_a: CHEBI:33426 ! chlorine oxoacid [Term] id: CHEBI:17323 name: trans-pinosylvin subset: chebi_ph7_3 is_a: CHEBI:36011 ! pinosylvin [Term] id: CHEBI:17325 name: 3-hydroxy-3-methylglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:133251 ! 3-hydroxydicarboxylate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17326 name: nucleoside 5'-triphoshate is_a: CHEBI:25608 ! nucleoside phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17327 name: phytol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:38941 ! schistosomicide drug relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17328 name: N(6)-[(indol-3-yl)acetyl]-L-lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:17329 name: UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N(6)-(L-alanyl)-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:17331 name: N-benzoylanthranilate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates is_a: CHEBI:61666 ! amidobenzoate [Term] id: CHEBI:17332 name: planteose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:17333 name: chorismic acid is_a: CHEBI:36166 ! 5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17334 name: penicillin is_a: CHEBI:25865 ! penicillanic acids relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:17335 name: 4-O-beta-D-glucosyl-4-coumaric acid is_a: CHEBI:24282 ! glucosyl hydroxycinnamic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:17336 name: all-trans-retinol subset: chebi_ph7_3 is_a: CHEBI:12777 ! vitamin A is_a: CHEBI:50211 ! retinol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17337 name: (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:17338 name: CDP-3,6-dideoxy-D-glucose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:17339 name: N(5)-acyl-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:17340 name: cetraxate is_a: CHEBI:23084 ! cetraxates relationship: has_role CHEBI:49201 ! anti-ulcer drug [Term] id: CHEBI:17342 name: L-2-aminohexano-6-lactam is_a: CHEBI:19471 ! 2-aminohexano-6-lactam is_a: CHEBI:25095 ! L-lysine derivative [Term] id: CHEBI:17343 name: cis-3,4-leucopelargonidin subset: chebi_ph7_3 is_a: CHEBI:60835 ! leucoanthocyanidin is_a: CHEBI:72584 ! pentahydroxyflavan [Term] id: CHEBI:17344 name: 2-carboxy-cis,cis-muconic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:17345 name: guanosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17346 name: 4-chlorophenylacetonitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:17347 name: testosterone subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17348 name: D-aldohexose 6-phosphate is_a: CHEBI:2559 ! aldohexose 6-phosphate is_a: CHEBI:4195 ! D-hexose 6-phosphate [Term] id: CHEBI:17349 name: 5-methyl-5,6,7,8-tetrahydromethanopterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:17351 name: linoleic acid is_a: CHEBI:25627 ! octadecadienoic acid is_a: CHEBI:36009 ! omega-6 fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17352 name: (R)-mandelamide subset: chebi_ph7_3 is_a: CHEBI:136824 ! mandelamide [Term] id: CHEBI:17354 name: 16beta-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:36840 ! 16-hydroxy steroid [Term] id: CHEBI:17355 name: (S)-2-acetamido-6-oxopimelic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:17356 name: 2-acetamidofluorene subset: chebi_ph7_3 is_a: CHEBI:19432 ! 2-acetamidofluorenes relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:64911 ! antimitotic [Term] id: CHEBI:17357 name: L-rhamnonic acid is_a: CHEBI:21376 ! rhamnonic acid [Term] id: CHEBI:17358 name: N(4)-phosphoagmatine is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:17359 name: sulfite subset: chebi_ph7_3 is_a: CHEBI:33482 ! sulfur oxoanion is_a: CHEBI:48154 ! sulfur oxide is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:17360 name: D-altronate subset: chebi_ph7_3 is_a: CHEBI:33530 ! altronate [Term] id: CHEBI:17361 name: cytidine 5'-monophosphate is_a: CHEBI:23521 ! cytidine 5'-phosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17362 name: quinoline subset: chebi_ph7_3 is_a: CHEBI:26513 ! quinolines is_a: CHEBI:35570 ! mancude organic heterobicyclic parent is_a: CHEBI:50893 ! azaarene is_a: CHEBI:52362 ! ortho-fused heteroarene [Term] id: CHEBI:17363 name: D-ribulose 5-phosphate is_a: CHEBI:37455 ! ribulose 5-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17364 name: D-aspartic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:22660 ! aspartic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17365 name: 2,4-dichloro-cis,cis-muconic acid is_a: CHEBI:38409 ! 2,4-dichloromuconic acid [Term] id: CHEBI:17367 name: 2-hydroxy-6-oxonona-2,4-dienedioic acid is_a: CHEBI:25576 ! nonadienedioic acid [Term] id: CHEBI:17368 name: hypoxanthine subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:26386 ! purine nucleobase is_a: CHEBI:67142 ! nucleobase analogue relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17369 name: D-mannose 6-phosphate is_a: CHEBI:616988 ! mannose 6-phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17371 name: macrocin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25022 ! leucomycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:17372 name: 1,2-dihydrovomilenine subset: chebi_ph7_3 is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:17374 name: N(6)-acetyl-N(6)-hydroxy-L-lysine is_a: CHEBI:21545 ! N-acetyl-L-amino acid [Term] id: CHEBI:17375 name: (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:17376 name: cystine is_a: CHEBI:23509 ! cysteine derivative is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:35489 ! organic disulfide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17377 name: bergaptol is_a: CHEBI:26369 ! psoralens is_a: CHEBI:52058 ! 5-hydroxyfurocoumarin [Term] id: CHEBI:17378 name: D-glyceraldehyde subset: chebi_ph7_3 is_a: CHEBI:5445 ! glyceraldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17379 name: isovitexin 2''-O-beta-D-glucoside is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17380 name: 3-hydroxy-L-kynurenine is_a: CHEBI:1547 ! 3-hydroxykynurenine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17381 name: porphobilinogen is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:64365 ! aralkylamino compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17382 name: 5'-O-beta-D-glucosylpyridoxine subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:27306 ! vitamin B6 [Term] id: CHEBI:17383 name: GDP-D-glucose is_a: CHEBI:29062 ! GDP-glucose [Term] id: CHEBI:17384 name: 17-O-acetylnorajmaline is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:17385 name: 3-(4-hydroxyphenyl)lactic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17387 name: O-acylcarnitine is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:17388 name: (S)-1-pyrroline-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:15893 ! 1-pyrroline-5-carboxylate [Term] id: CHEBI:17389 name: 2-monoglyceride subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:76575 ! monoradylglycerol [Term] id: CHEBI:17390 name: allocryptopine subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38608 ! dibenzazecine alkaloid is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:59770 ! cyclic acetal [Term] id: CHEBI:17391 name: 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside subset: chebi_ph7_3 is_a: CHEBI:20961 ! D-galactoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17393 name: D-allose is_a: CHEBI:17608 ! D-aldohexose is_a: CHEBI:37690 ! allose [Term] id: CHEBI:17394 name: N(5)-ethyl-L-glutamine is_a: CHEBI:21844 ! N(5)-alkyl-L-glutamine relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17395 name: cis-caffeic acid is_a: CHEBI:36281 ! caffeic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17396 name: (R)-prunasin subset: chebi_ph7_3 is_a: CHEBI:25150 ! prunasin [Term] id: CHEBI:17397 name: 3-methyloxindole subset: chebi_ph7_3 is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:38460 ! methylindole [Term] id: CHEBI:17399 name: L-xylulose subset: chebi_ph7_3 is_a: CHEBI:27353 ! xylulose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17400 name: raucaffricine subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:17401 name: myo-inositol hexakisphosphate is_a: CHEBI:25445 ! myo-inositol hexakisphosphates relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17402 name: 2-methylpropanoyl phosphate is_a: CHEBI:16826 ! acyl monophosphate [Term] id: CHEBI:17403 name: 3-chloro-L-alanine is_a: CHEBI:83943 ! L-alanine derivative is_a: CHEBI:88164 ! 3-chloroalanine [Term] id: CHEBI:17404 name: indan-1-one subset: chebi_ph7_3 is_a: CHEBI:38132 ! indanone [Term] id: CHEBI:17405 name: 4-pyridoxic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38196 ! hydroxymethylpyridine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:17406 name: 3-(imidazol-5-yl)pyruvic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25754 ! oxo carboxylic acid [Term] id: CHEBI:17407 name: 2-trans,6-trans-farnesyl diphosphate is_a: CHEBI:50277 ! farnesyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17408 name: monoacylglycerol subset: chebi_ph7_3 is_a: CHEBI:47778 ! glyceride [Term] id: CHEBI:17409 name: 10-hydroxycapric acid is_a: CHEBI:194303 ! omega-hydroxy-medium-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid [Term] id: CHEBI:17410 name: pteridine-2,4,6,7-tetrol subset: chebi_ph7_3 is_a: CHEBI:26373 ! pteridines [Term] id: CHEBI:17412 name: R'C(R)S-S(R)CR' subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:48343 ! disulfide [Term] id: CHEBI:17413 name: 2-(hydroxymethyl)-4-oxobutanoic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:17415 name: 2,5-dioxopentanoic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:17416 name: 3,4-dihydroxyphthalic acid is_a: CHEBI:24676 ! hydroxybenzoic acid [Term] id: CHEBI:17417 name: N-caffeoylputrescine is_a: CHEBI:26406 ! N-substituted putrescine [Term] id: CHEBI:17418 name: valeric acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17419 name: 3-hydroxy-cis,cis-muconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:24553 ! hexadienedioic acid [Term] id: CHEBI:17420 name: tetrahydropteroyltri-L-glutamic acid is_a: CHEBI:26920 ! tetrahydropteroyltri-L-glutamate [Term] id: CHEBI:17421 name: heparan sulfate N-acetyl-alpha-D-glucosaminide is_a: CHEBI:24495 ! heparan alpha-D-glucosaminide is_a: CHEBI:27425 ! N-acetyl-alpha-D-glucosaminide is_a: CHEBI:35721 ! heparan sulfates [Term] id: CHEBI:17422 name: P(1),P(4)-bis(5'-adenosyl) tetraphosphate is_a: CHEBI:63738 ! diadenosyl tetraphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17424 name: 4-carboxy-2-hydroxy-cis,cis-muconic acid is_a: CHEBI:16321 ! 4-carboxy-2-hydroxyhexa-2,4-dienedioic acid [Term] id: CHEBI:17425 name: 1-pyrroline-2-carboxylate is_a: CHEBI:26457 ! 1-pyrrolinecarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17426 name: 5-dehydro-D-gluconic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17427 name: 3-hydroxy-L-aspartate residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:17428 name: (R)-reticuline is_a: CHEBI:26533 ! reticuline [Term] id: CHEBI:17429 name: 3-ketosucrose subset: chebi_ph7_3 is_a: CHEBI:24407 ! glycosyl glycoside is_a: CHEBI:24957 ! keto-disaccharide [Term] id: CHEBI:17431 name: agmatine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17433 name: queuine subset: chebi_ph7_3 is_a: CHEBI:38670 ! pyrrolopyrimidine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17434 name: trimethylsulfonium subset: chebi_ph7_3 is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:17435 name: naphthalene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:38133 ! naphthalenediol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17436 name: (R)-5-phosphomevalonic acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36952 ! carboxyalkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17437 name: dimethyl sulfide subset: chebi_ph7_3 is_a: CHEBI:22327 ! aliphatic sulfide relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17438 name: O-beta-D-xylosylzeatin subset: chebi_ph7_3 is_a: CHEBI:27926 ! beta-D-xyloside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17439 name: cyanocob(III)alamin subset: chebi_ph7_3 is_a: CHEBI:140785 ! R-cob(III)alamin is_a: CHEBI:23333 ! cob(III)alamins [Term] id: CHEBI:17440 name: 4-nitrophenyl phosphate is_a: CHEBI:36943 ! aryl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17441 name: chlorite subset: chebi_ph7_3 is_a: CHEBI:33437 ! chlorine oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:17442 name: 4-(2-aminophenyl)-2,4-dioxobutanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17443 name: L-homocitrulline is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:47857 ! ureas is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17445 name: 3-hydroxyphenylacetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17446 name: 3-D-glucuronosyl-N(2),6-disulfo-beta-D-glucosamine is_a: CHEBI:21794 ! N-sulfoglucosamine is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:37878 ! glucosamine sulfate is_a: CHEBI:63361 ! glycosylglucose derivative [Term] id: CHEBI:17447 name: geraniol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24221 ! 3,7-dimethylocta-2,6-dien-1-ol is_a: CHEBI:25409 ! monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17448 name: methanofuran is_a: CHEBI:24129 ! furans [Term] id: CHEBI:17450 name: cis-4-coumaric acid is_a: CHEBI:36090 ! 4-coumaric acid [Term] id: CHEBI:17453 name: methylmalonate(2-) subset: chebi_ph7_3 is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17454 name: UDP-L-rhamnose is_a: CHEBI:63061 ! UDP-rhamnose [Term] id: CHEBI:17455 name: N-(2,3-dihydroxybenzoyl)-L-serine is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17456 name: dithioerythritol subset: chebi_ph7_3 is_a: CHEBI:25189 ! 1,4-dimercaptobutane-2,3-diol relationship: has_role CHEBI:63247 ! reducing agent [Term] id: CHEBI:17457 name: 14'-apo-beta-carotenal subset: chebi_ph7_3 is_a: CHEBI:23041 ! carotenal is_a: CHEBI:51688 ! enal [Term] id: CHEBI:17458 name: N-methyltyramine is_a: CHEBI:27175 ! tyramines relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17459 name: D-iditol subset: chebi_ph7_3 is_a: CHEBI:24766 ! iditol relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:17460 name: lipoamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:39192 ! dithiolanes relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17464 name: L-galactono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:24150 ! galactonolactone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17465 name: phaseollidin hydrate subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:17466 name: GDP-D-mannuronate subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:17467 name: 4-(dimethylamino)phenylazoxybenzene subset: chebi_ph7_3 is_a: CHEBI:37390 ! azoxy compound [Term] id: CHEBI:17468 name: (4-bromophenylsulfanyl)pyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:17469 name: N-adenylylanthranilic acid is_a: CHEBI:37773 ! organic phosphoramidate [Term] id: CHEBI:17470 name: 2-O-caffeoylglucaric acid is_a: CHEBI:33797 ! glucaric acid derivative [Term] id: CHEBI:17473 name: 1-alkyl-2-acetyl-3-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:36727 ! 1-alkyl-2,3-diacylglycerol [Term] id: CHEBI:17474 name: estrone 3-sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:19168 ! 17-oxo steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17475 name: aminomalonic acid is_a: CHEBI:36164 ! amino dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17476 name: 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine is_a: CHEBI:76170 ! olefinic phospholipid [Term] id: CHEBI:17477 name: uracil-5-carboxylic acid is_a: CHEBI:26447 ! pyrimidinemonocarboxylic acid [Term] id: CHEBI:17478 name: aldehyde subset: chebi_ph7_3 is_a: CHEBI:36586 ! carbonyl compound relationship: has_part CHEBI:42485 ! formyl group [Term] id: CHEBI:17479 name: enol-oxaloacetate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:17482 name: L-cystathionine is_a: CHEBI:17755 ! cystathionine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17484 name: benzyl isothiocyanate subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:52221 ! isothiocyanate relationship: has_role CHEBI:36047 ! antibacterial drug [Term] id: CHEBI:17485 name: homocystine is_a: CHEBI:24612 ! homocystines relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17486 name: (S)-atropine is_a: CHEBI:78734 ! tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate [Term] id: CHEBI:17488 name: scopoletin subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:26155 ! plant growth regulator relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17489 name: 3',5'-cyclic AMP is_a: CHEBI:19834 ! 3',5'-cyclic purine nucleotide is_a: CHEBI:61296 ! adenyl ribonucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17490 name: O-palmitoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:73067 ! O-palmitoylcarnitine relationship: has_role CHEBI:63510 ! EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17491 name: S-(2-hydroxyacyl)glutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:17494 name: CDP-4-dehydro-6-deoxy-D-glucose is_a: CHEBI:20873 ! CDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:17495 name: cholesteryl beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17497 name: glycolic acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50176 ! keratolytic drug [Term] id: CHEBI:17499 name: hydrogen donor subset: chebi_ph7_3 is_a: CHEBI:15022 ! electron donor [Term] id: CHEBI:17500 name: 7alpha-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17501 name: 3,3'-dimethoxystilbene-4,4'-diol subset: chebi_ph7_3 is_a: CHEBI:36027 ! stilbenol [Term] id: CHEBI:17502 name: 2-methylpropanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:17503 name: N-acyl-D-glutamates(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:17504 name: 1-O-acyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:11230 ! 1-acylglycerophosphocholine(1+) is_a: CHEBI:60479 ! lysophosphatidylcholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17505 name: alpha-D-galactosyl-(1->3)-1D-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:46953 ! alpha-D-galactoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17506 name: 2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate is_a: CHEBI:24167 ! galactosylglycerol phosphate [Term] id: CHEBI:17507 name: psychosine sulfate is_a: CHEBI:36477 ! sulfoglycosphingolipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17508 name: 7,8-dihydroxykynurenic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid is_a: CHEBI:38774 ! hydroxyquinoline [Term] id: CHEBI:17509 name: 5'-S-methyl-5'-thioadenosine subset: chebi_ph7_3 is_a: CHEBI:26953 ! thioadenosine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17510 name: dTDP-D-fucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:17511 name: 3-O-L-alanyl-1-O-phosphatidylglycerol is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:17512 name: methyl 2-O-alpha-L-fucopyranosyl-beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:25302 ! methyl glycoside is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:17514 name: cyanide is_a: CHEBI:36828 ! pseudohalide anion relationship: has_role CHEBI:38500 ! EC 1.9.3.1 (cytochrome c oxidase) inhibitor [Term] id: CHEBI:17515 name: L-gamma-glutamyl-L-cysteine is_a: CHEBI:24195 ! gamma-glutamylcysteine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17516 name: but-1-ene-1,2,4-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:17517 name: phosphatidylglycerol is_a: CHEBI:24360 ! glycerophosphoglycerols relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17519 name: N-methyl-L-alanine is_a: CHEBI:25264 ! methyl-L-alanine [Term] id: CHEBI:17520 name: phenylthioacetohydroximic acid is_a: CHEBI:22179 ! acetohydroximates is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:17521 name: (-)-quinic acid is_a: CHEBI:26493 ! quinic acid [Term] id: CHEBI:17522 name: alditol subset: chebi_ph7_3 is_a: CHEBI:16646 ! carbohydrate is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:17524 name: 6-alkylaminopurine subset: chebi_ph7_3 is_a: CHEBI:20706 ! 6-aminopurines [Term] id: CHEBI:17525 name: testolic acid is_a: CHEBI:26616 ! seco-androstane [Term] id: CHEBI:17526 name: 1-phosphatidyl-1D-myo-inositol 4-phosphate is_a: CHEBI:37530 ! phosphatidylinositol 4-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17527 name: 1,2,3,6-tetrakis-O-galloyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:24183 ! galloyl beta-D-glucose is_a: CHEBI:37576 ! gallate ester [Term] id: CHEBI:17528 name: all-trans-hexaprenyl diphosphate is_a: CHEBI:53047 ! hexaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17529 name: kievitone hydrate subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:72739 ! hydroxyisoflavanone [Term] id: CHEBI:17530 name: L-arogenic acid is_a: CHEBI:21239 ! arogenic acid [Term] id: CHEBI:17531 name: trans-beta-D-glucosyl-2-hydroxycinnamic acid is_a: CHEBI:24282 ! glucosyl hydroxycinnamic acid [Term] id: CHEBI:17532 name: (S)-6-hydroxynicotine is_a: CHEBI:24729 ! 6-hydroxynicotine [Term] id: CHEBI:17533 name: N-acetyl-L-glutamic acid is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17534 name: 6-amino-2-oxohexanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35958 ! epsilon-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17535 name: L-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:30849 ! L-arabinose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17536 name: allantoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17537 name: Tyr-Arg is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:17539 name: 9-cis,11-trans-octadecadienoate subset: chebi_ph7_3 is_a: CHEBI:38393 ! octadeca-9,11-dienoate [Term] id: CHEBI:17540 name: methyl beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:25263 ! methyl D-galactoside is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17541 name: 2-carboxy-D-arabinitol 1-phosphate is_a: CHEBI:37392 ! ribonic acid phosphate [Term] id: CHEBI:17543 name: 1-phospho-alpha-D-galacturonic acid is_a: CHEBI:35139 ! uronic acid phosphate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17544 name: hydrogencarbonate subset: chebi_ph7_3 is_a: CHEBI:35604 ! carbon oxoanion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17545 name: (E)-indol-3-ylacetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:28311 ! indol-3-ylacetaldehyde oxime [Term] id: CHEBI:17546 name: (2Z)-5-isopropyl-2-methylhexa-2,5-dienal subset: chebi_ph7_3 is_a: CHEBI:24551 ! hexadienal [Term] id: CHEBI:17548 name: alginic acid is_a: CHEBI:16966 ! heteroglycan is_a: CHEBI:53310 ! copolymer macromolecule is_a: CHEBI:72813 ! exopolysaccharide relationship: has_role CHEBI:50248 ! hematologic agent [Term] id: CHEBI:17549 name: 5-aminolevulinic acid is_a: CHEBI:35931 ! delta-amino acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17550 name: UDP-N-acetyl-D-galactosamine 4-sulfate is_a: CHEBI:37861 ! nucleotide-sugar sulfate [Term] id: CHEBI:17551 name: ecdysone palmitate subset: chebi_ph7_3 is_a: CHEBI:23895 ! ecdysteroid ester is_a: CHEBI:25835 ! hexadecanoate ester [Term] id: CHEBI:17552 name: GDP is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate relationship: has_role CHEBI:145437 ! uncoupling protein inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17553 name: O-phosphoethanolamine is_a: CHEBI:36711 ! phosphoethanolamine is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17555 name: 1-alkyl-2-acetyl-sn-glycerol 3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:17556 name: phaseollidin subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans [Term] id: CHEBI:17558 name: quercitrin is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:38684 ! tetrahydroxyflavone is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:76424 ! quercetin O-glycoside relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:48550 ! EC 1.1.1.21 (aldehyde reductase) inhibitor relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:70868 ! antileishmanial agent relationship: has_role CHEBI:73136 ! EC 1.1.1.184 [carbonyl reductase (NADPH)] inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17559 name: 3alpha(S)-strictosidine is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38481 ! alkaloid ester is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:17560 name: 2,2'-iminodipropanoate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:17561 name: L-cysteine is_a: CHEBI:15356 ! cysteine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:26650 ! serine family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:64577 ! flour treatment agent relationship: has_role CHEBI:77703 ! EC 4.3.1.3 (histidine ammonia-lyase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17562 name: cytidine subset: chebi_ph7_3 is_a: CHEBI:23524 ! cytidines relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17563 name: phthalate(2-) subset: chebi_ph7_3 is_a: CHEBI:26092 ! phthalate is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17566 name: indole-3-acetonitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:24828 ! indoles relationship: has_role CHEBI:22676 ! auxin relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17567 name: O-alkylglycerone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:24358 ! glycerone derivative is_a: CHEBI:25698 ! ether [Term] id: CHEBI:17568 name: uracil subset: chebi_ph7_3 is_a: CHEBI:26432 ! pyrimidine nucleobase is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17571 name: beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21524 ! N-acetyl-D-glucosaminyl groups [Term] id: CHEBI:17572 name: 5-amino-2-oxopentanoate is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:17573 name: glycyrrhetinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:17574 name: biochanin A is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38637 ! tyrosine kinase inhibitor relationship: has_role CHEBI:64033 ! EC 3.5.1.99 (fatty acid amide hydrolase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:17575 name: S-(5-deoxy-D-ribos-5-yl)-L-homocysteine is_a: CHEBI:24610 ! homocysteines [Term] id: CHEBI:17576 name: (3R)-3-hydroxy-L-aspartic acid is_a: CHEBI:48423 ! 3-hydroxy-L-aspartic acid [Term] id: CHEBI:175763 name: 2-trans,6-trans-farnesyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17578 name: toluene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:27024 ! toluenes is_a: CHEBI:38975 ! methylbenzene relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:48873 ! cholinergic antagonist relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:62803 ! fuel additive [Term] id: CHEBI:17579 name: beta-carotene subset: chebi_ph7_3 is_a: CHEBI:139120 ! carotenoid beta-end derivative is_a: CHEBI:35163 ! cyclic carotene relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:67200 ! provitamin A relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17580 name: linalool subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17581 name: N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactosyl-1,3-(N-acetyl-beta-D-glucosaminyl-1,6)-N-acetyl-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group [Term] id: CHEBI:17582 name: isochorismic acid is_a: CHEBI:36166 ! 5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid [Term] id: CHEBI:17583 name: N-(long-chain-fatty-acyl)-L-glutamate subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:17585 name: trans-hexadec-2-enal subset: chebi_ph7_3 is_a: CHEBI:13757 ! n-alk-2-enal is_a: CHEBI:24547 ! hexadecenal is_a: CHEBI:84588 ! trans-2,3-unsaturated fatty aldehyde [Term] id: CHEBI:17586 name: CoA-glutathione is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:17587 name: L-gulono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:37433 ! gulonolactone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17588 name: L-homocysteine is_a: CHEBI:17230 ! homocysteine is_a: CHEBI:26650 ! serine family amino acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17589 name: 3-chloro-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38411 ! chlorocarboxylic acid anion [Term] id: CHEBI:17590 name: octane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:175901 name: gemcitabine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside is_a: CHEBI:37143 ! organofluorine compound relationship: has_role CHEBI:132992 ! radiosensitizing agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:36044 ! antiviral drug relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor relationship: has_role CHEBI:74213 ! EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:17592 name: N(5)-methyl-L-glutamine is_a: CHEBI:21760 ! N-methyl-amino acid is_a: CHEBI:21844 ! N(5)-alkyl-L-glutamine [Term] id: CHEBI:17593 name: maltooligosaccharide is_a: CHEBI:24268 ! glucooligosaccharide [Term] id: CHEBI:17594 name: hydroquinone subset: chebi_ph7_3 is_a: CHEBI:17701 ! benzenediol is_a: CHEBI:24646 ! hydroquinones relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:85046 ! skin lightening agent [Term] id: CHEBI:17596 name: inosine subset: chebi_ph7_3 is_a: CHEBI:142355 ! purines D-ribonucleoside is_a: CHEBI:24844 ! inosines relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17597 name: 4-hydroxybenzaldehyde subset: chebi_ph7_3 is_a: CHEBI:24673 ! hydroxybenzaldehyde relationship: has_role CHEBI:139339 ! EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17598 name: phorbol 12,13-dibutanoate subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:37532 ! phorbol ester is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:17600 name: hexadecanal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84587 ! 2,3-saturated fatty aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17601 name: 6,7-dimethyl-8-(1-D-ribityl)lumazine is_a: CHEBI:26373 ! pteridines relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17602 name: 4-aminophenol subset: chebi_ph7_3 is_a: CHEBI:28829 ! aminophenol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:17604 name: N(6)-methyl-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:17605 name: 2-formylbenzoic acid is_a: CHEBI:22698 ! benzaldehydes is_a: CHEBI:26643 ! aldehydic acid relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:17606 name: diiodine subset: chebi_ph7_3 is_a: CHEBI:36891 ! diatomic iodine relationship: has_role CHEBI:33284 ! nutrient [Term] id: CHEBI:17607 name: 1,5-dihydroriboflavin subset: chebi_ph7_3 is_a: CHEBI:15031 ! dihydroriboflavins is_a: CHEBI:62787 ! 1,5-dihydroflavin [Term] id: CHEBI:17608 name: D-aldohexose is_a: CHEBI:33917 ! aldohexose is_a: CHEBI:4194 ! D-hexose [Term] id: CHEBI:17609 name: cortisol 21-acetate subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:23396 ! cortisol ester [Term] id: CHEBI:17610 name: 3-nitroacrylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:17611 name: 3-hydroxycyclohexanone subset: chebi_ph7_3 is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:17612 name: (3,4-dihydroxyphenyl)acetate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17613 name: all-trans-heptaprenyl diphosphate is_a: CHEBI:53046 ! heptaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate [Term] id: CHEBI:17614 name: 5-methyltetrahydropteroyltri-L-glutamic acid is_a: CHEBI:26920 ! tetrahydropteroyltri-L-glutamate [Term] id: CHEBI:17615 name: 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:61799 ! beta-D-galactopyranosyl diglyceride is_a: CHEBI:90549 ! 1-monohexosyl-2,3-diacylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17616 name: all-trans-retinyl palmitate subset: chebi_ph7_3 is_a: CHEBI:15040 ! retinyl palmitate is_a: CHEBI:63410 ! all-trans-retinyl ester relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17617 name: L-fuculose subset: chebi_ph7_3 is_a: CHEBI:24965 ! deoxyketohexose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17618 name: bis-D-fructose 2',1:2,1'-dianhydride subset: chebi_ph7_3 is_a: CHEBI:33922 ! sugar dianhydride [Term] id: CHEBI:17619 name: 4-(3-methylbut-2-enyl)-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:17620 name: ferulic acid is_a: CHEBI:24031 ! ferulic acids relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:64345 ! MALDI matrix material relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77307 ! cardioprotective agent [Term] id: CHEBI:17621 name: FMN is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:24041 ! flavin mononucleotide relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17622 name: dUMP is_a: CHEBI:23641 ! deoxyuridine phosphate is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17623 name: cyclomaltodextrin subset: chebi_ph7_3 is_a: CHEBI:23448 ! cyclic oligosaccharide is_a: CHEBI:25140 ! maltodextrin [Term] id: CHEBI:17624 name: dolichyl beta-D-mannosyl phosphate is_a: CHEBI:15809 ! dolichyl D-mannosyl phosphate [Term] id: CHEBI:17625 name: dUTP is_a: CHEBI:23641 ! deoxyuridine phosphate is_a: CHEBI:37043 ! pyrimidine 2'-deoxyribonucleoside 5'-triphosphate relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17626 name: citraconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17627 name: ferroheme b is_a: CHEBI:26355 ! heme b is_a: CHEBI:38573 ! ferroheme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17628 name: 2-aminoacetaldehyde is_a: CHEBI:22492 ! amino aldehyde is_a: CHEBI:27390 ! omega-aminoaldehyde relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17630 name: kanamycin A is_a: CHEBI:24951 ! kanamycins relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:17631 name: alpha-D-Manp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-D-Manp subset: chebi_ph7_3 is_a: CHEBI:149433 ! mannotetraose [Term] id: CHEBI:17632 name: nitrate subset: chebi_ph7_3 is_a: CHEBI:33458 ! nitrogen oxoanion is_a: CHEBI:62764 ! reactive nitrogen species is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:17633 name: guanosine 3',5'-bis(diphosphate) is_a: CHEBI:37124 ! guanosine bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:176338 name: 2-N,3-O-bis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:137180 ! 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate [Term] id: CHEBI:17634 name: D-glucose is_a: CHEBI:17234 ! glucose is_a: CHEBI:17608 ! D-aldohexose [Term] id: CHEBI:176343 name: 2,3,2',3'-tetrakis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:17636 name: sphingomyelin d18:1 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:17637 name: 6-methylsalicylic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:17639 name: 3-oxo-5beta-cholanic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid [Term] id: CHEBI:17640 name: 3-(indol-3-yl)pyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:38468 ! indol-3-yl carboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17642 name: pentachlorophenol is_a: CHEBI:23150 ! chlorophenol is_a: CHEBI:38656 ! organochlorine pesticide is_a: CHEBI:83390 ! pentachlorobenzenes is_a: CHEBI:87034 ! aromatic fungicide relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:176425 name: a lipid IVA(4-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:176428 name: a Kdo-lipid IVA(5-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:176429 name: a (Kdo)2-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:17643 name: 9-riburonosylhypoxanthine is_a: CHEBI:26394 ! purine nucleoside [Term] id: CHEBI:176430 name: a (Kdo)2-(acyl)-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:176431 name: an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:17645 name: 4-acetamidobutanoic acid is_a: CHEBI:134018 ! N-acyl-gamma-aminobutyric acid is_a: CHEBI:22160 ! acetamides relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17646 name: mevaldic acid is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:17647 name: 2-dehydro-3-deoxy-L-arabinonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33753 ! pentonic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:17648 name: N-adenylyl-L-phenylalanine is_a: CHEBI:84144 ! L-phenylalanine derivative [Term] id: CHEBI:17649 name: hydroxymalonate(2-) subset: chebi_ph7_3 is_a: CHEBI:24711 ! hydroxymalonate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:176497 name: geroprotector is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:17650 name: cortisol subset: chebi_ph7_3 is_a: CHEBI:138141 ! 17alpha-hydroxy-C21-steroid is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:24261 ! glucocorticoid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:49167 ! anti-asthmatic drug relationship: has_role CHEBI:50857 ! anti-allergic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:17652 name: 3-hydroxy-L-glutamate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:176527 name: (2S)-3-sulfopropanediol(1-) subset: chebi_ph7_3 is_a: CHEBI:77138 ! 3-sulfopropanediol(1-) [Term] id: CHEBI:17654 name: electron acceptor is_a: CHEBI:15339 ! acceptor [Term] id: CHEBI:176541 name: omega-methyl-very-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion [Term] id: CHEBI:176542 name: omega-hydroxy-very-long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76307 ! omega-hydroxy fatty acid anion [Term] id: CHEBI:17655 name: 4-hydroxy-2-oxopentanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:176556 name: N-(fatty acyl)-L-alaninate(1-) subset: chebi_ph7_3 is_a: CHEBI:136716 ! N-(fatty acyl)-L-alpha-amino acid anion [Term] id: CHEBI:176557 name: oxidized N-(fatty acyl)-L-alaninate(1-) subset: chebi_ph7_3 is_a: CHEBI:176556 ! N-(fatty acyl)-L-alaninate(1-) [Term] id: CHEBI:17656 name: (R)-mandelic acid is_a: CHEBI:35825 ! mandelic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:176568 name: oxidized N-(fatty acyl)-gamma-aminobutyrate(1-) subset: chebi_ph7_3 is_a: CHEBI:133575 ! N-acyl-gamma-aminobutyrate [Term] id: CHEBI:17658 name: tylosin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25022 ! leucomycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:176587 name: oxidized eicosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:176588 name: oxidized icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:17659 name: UDP is_a: CHEBI:27232 ! uridine 5'-phosphate is_a: CHEBI:37039 ! pyrimidine ribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17660 name: N(6)-dimethylallyladenine subset: chebi_ph7_3 is_a: CHEBI:38643 ! 6-isopentenylaminopurine relationship: has_role CHEBI:23530 ! cytokinin [Term] id: CHEBI:17661 name: GDP-6-deoxy-alpha-D-mannose is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:17663 name: (R)-3-[(R)-3-hydroxybutanoyloxy]butanoic acid is_a: CHEBI:140392 ! (3R)-3-hydroxybutanoic acid oligomer is_a: CHEBI:33308 ! carboxylic ester relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:17664 name: alkylaminium subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:176642 name: oxidized ceramide subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:17665 name: alpha-D-glucose 6-phosphate is_a: CHEBI:4170 ! D-glucopyranose 6-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:176657 name: 1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3,5-dione subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:51689 ! enone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:78802 ! diarylheptanoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17666 name: L-ribulose 5-phosphate is_a: CHEBI:37455 ! ribulose 5-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17667 name: 3-hydroxy-3-methyl-2-oxobutanoic acid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:17668 name: ribonucleoside diphosphate is_a: CHEBI:16862 ! nucleoside 5'-diphosphate [Term] id: CHEBI:17670 name: 1,2-diacyl-3-O-(alpha-D-glucosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24262 ! glucoglycerolipid relationship: has_part CHEBI:30684 ! alpha-D-glucosyl group [Term] id: CHEBI:17671 name: 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde is_a: CHEBI:18634 ! (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde [Term] id: CHEBI:17672 name: carbamoyl phosphate is_a: CHEBI:16826 ! acyl monophosphate is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17675 name: Watasenia luciferin is_a: CHEBI:37847 ! imidazopyrazine is_a: CHEBI:37919 ! aryl sulfate relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:17676 name: 2-(beta-D-glucopyranosyluronic acid)-D-glucuronic acid is_a: CHEBI:24405 ! glycosylglucose is_a: CHEBI:33886 ! glucuronic acids [Term] id: CHEBI:17677 name: CTP is_a: CHEBI:23521 ! cytidine 5'-phosphate is_a: CHEBI:37044 ! pyrimidine ribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17678 name: 2'-hydroxyformononetin is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:176783 name: vitamin C is_a: CHEBI:50523 ! butenolide relationship: has_role CHEBI:27314 ! water-soluble vitamin (role) [Term] id: CHEBI:17679 name: 5-hydroxybenzimidazolylcob(I)amide is_a: CHEBI:23341 ! cobamides relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:17680 name: D-glucose 1,6-bisphosphate is_a: CHEBI:21005 ! D-glucose bisphosphate [Term] id: CHEBI:176809 name: cis-alpha-bergamotene is_a: CHEBI:62755 ! alpha-bergamotene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17681 name: pyridine-2,6-diol subset: chebi_ph7_3 is_a: CHEBI:23793 ! dihydroxypyridine [Term] id: CHEBI:17682 name: benzoin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:51586 ! benzoins relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor [Term] id: CHEBI:17683 name: UDP-L-iduronic acid is_a: CHEBI:17297 ! UDP-sugar is_a: CHEBI:24768 ! iduronates [Term] id: CHEBI:176838 name: vitamin B2 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:176839 name: vitamin B3 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:17684 name: N-formyl-L-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:176840 name: vitamin B5 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:176841 name: vitamin B7 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:176842 name: vitamin B9 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:176843 name: vitamin B12 is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:17685 name: 3-hydroxyquinine is_a: CHEBI:51323 ! cinchona alkaloid [Term] id: CHEBI:17687 name: glycocholic acid is_a: CHEBI:36255 ! bile acid glycine conjugate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17688 name: (S)-nicotine is_a: CHEBI:138000 ! 3-(1-methylpyrrolidin-2-yl)pyridine relationship: has_role CHEBI:22917 ! phytogenic insecticide relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35474 ! anxiolytic drug relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:47958 ! nicotinic acetylcholine receptor agonist relationship: has_role CHEBI:49110 ! peripheral nervous system drug relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:52290 ! mitogen relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:176888 name: 4-O-feruloylquinic acid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:17689 name: sphingosine-1-phosphocholine is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36700 ! phosphocholines [Term] id: CHEBI:176894 name: vitamin B6 phosphate anion is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:17691 name: N-feruloylglycine is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:176910 name: fatty acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:61697 ! fatty acid derivative is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:17692 name: cis-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid is_a: CHEBI:36194 ! cyclohexadienedicarboxylic acid [Term] id: CHEBI:17693 name: 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:38183 ! pyridone [Term] id: CHEBI:17694 name: dihydrolipoamide subset: chebi_ph7_3 is_a: CHEBI:23853 ! dithiol is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17695 name: casbene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:17696 name: isocyanuric acid subset: chebi_ph7_3 is_a: CHEBI:38779 ! 1,3,5-triazinanes relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:176962 name: presqualene alcohol subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:17697 name: N-acetylserotonin subset: chebi_ph7_3 is_a: CHEBI:134175 ! N-acylserotonin is_a: CHEBI:22160 ! acetamides is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:140489 ! tropomyosin-related kinase B receptor agonist relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17698 name: chloramphenicol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37622 ! carboxamide relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17699 name: 16-hydroxytabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid [Term] id: CHEBI:17700 name: undecan-2-one subset: chebi_ph7_3 is_a: CHEBI:18044 ! dialkyl ketone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:33288 ! rodenticide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17701 name: benzenediol is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:17702 name: D-apiitol subset: chebi_ph7_3 is_a: CHEBI:48310 ! apiitol [Term] id: CHEBI:17703 name: 26-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor [Term] id: CHEBI:17704 name: aspulvinone E is_a: CHEBI:155902 ! 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one is_a: CHEBI:22669 ! aspulvinone relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:17705 name: N(2)-succinyl-L-arginine is_a: CHEBI:21645 ! N-acyl-L-arginine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17706 name: Renilla luciferyl sulfate is_a: CHEBI:37839 ! heterocyclyl sulfate [Term] id: CHEBI:17707 name: glucuronoxylan D-glucuronate is_a: CHEBI:33903 ! glucuronates [Term] id: CHEBI:177077 name: 1,2-dihexanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:17708 name: 1,6-dihydroxycyclohexa-2,4-dienecarboxylate subset: chebi_ph7_3 is_a: CHEBI:23466 ! cyclohexadienecarboxylate [Term] id: CHEBI:17709 name: 5'-adenylyl sulfate is_a: CHEBI:16826 ! acyl monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37875 ! acyl sulfate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17710 name: (R)-mevalonic acid is_a: CHEBI:194519 ! 3,5-dihydroxy-3-methylpentanoic acid [Term] id: CHEBI:17711 name: nocardicin A is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:25572 ! nocardicin is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:84133 ! D-serine derivative [Term] id: CHEBI:17712 name: 9H-xanthine subset: chebi_ph7_3 is_a: CHEBI:15318 ! xanthine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17713 name: 2'-deoxyadenosine 5'-monophosphate is_a: CHEBI:19237 ! 2'-deoxyadenosine 5'-phosphate is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17715 name: quinoline-2,8-diol subset: chebi_ph7_3 is_a: CHEBI:26507 ! dihydroxyquinoline [Term] id: CHEBI:17716 name: lactose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17717 name: sulfoacetaldehyde is_a: CHEBI:33551 ! organosulfonic acid is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:17719 name: beta-D-glucose 6-phosphate is_a: CHEBI:4170 ! D-glucopyranose 6-phosphate relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17720 name: 2,3-bisphospho-D-glyceric acid is_a: CHEBI:28907 ! 2,3-bisphosphoglyceric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:17721 name: (S,S,S)-nicotianamine is_a: CHEBI:25520 ! nicotianamine relationship: has_role CHEBI:35457 ! EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17723 name: beta-D-galactosyl-1,3-(N-acetyl-D-glucosaminyl-1,6)-N-acetyl-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group [Term] id: CHEBI:17724 name: N,N-dimethylglycine is_a: CHEBI:21760 ! N-methyl-amino acid is_a: CHEBI:21766 ! N-methylglycines relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17725 name: alpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosamine is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:17726 name: [Glu(-Cys)]n-Gly is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:17727 name: phorbol 13-butanoate subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:37532 ! phorbol ester is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:177275 name: 2-Phenylpropionate subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:17728 name: S-methyl-L-methionine is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17729 name: (S)-norcoclaurine is_a: CHEBI:25591 ! norcoclaurine [Term] id: CHEBI:17730 name: quercetin 3-sulfate is_a: CHEBI:26482 ! quercetin sulfate is_a: CHEBI:38684 ! tetrahydroxyflavone [Term] id: CHEBI:17732 name: Ala-tRNA(Ala) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17733 name: aldehydo-D-galactose 6-phosphate is_a: CHEBI:12937 ! D-galactose 6-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:177332 name: carbotetracyclic compound is_a: CHEBI:177333 ! organic tetracyclic compound is_a: CHEBI:35294 ! carbopolycyclic compound [Term] id: CHEBI:177333 name: organic tetracyclic compound is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:177334 name: 3',2'-cGAMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:17734 name: alpha-cyclopiazonic acid is_a: CHEBI:12336 ! alpha-cyclopiazonic acids [Term] id: CHEBI:17735 name: N,N-dimethylaniline N-oxide subset: chebi_ph7_3 is_a: CHEBI:134363 ! tertiary amine oxide is_a: CHEBI:23806 ! dimethylaniline [Term] id: CHEBI:17736 name: S-(4-bromophenyl)-L-cysteine is_a: CHEBI:22930 ! bromoamino acid is_a: CHEBI:27532 ! L-cysteine thioether [Term] id: CHEBI:17737 name: desmosterol subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17738 name: N-methyl-2-oxoglutaramate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:1774 name: (E)-4-(trimethylammonio)but-2-enoic acid is_a: CHEBI:48867 ! 4-(trimethylammonio)but-2-enoic acid [Term] id: CHEBI:17740 name: 3-oxoalanine is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:17741 name: N,N-dimethylformamide subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:24079 ! formamides relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:50908 ! hepatotoxic agent [Term] id: CHEBI:17742 name: 4-hydroxy-2-oxoglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17745 name: coniferol subset: chebi_ph7_3 is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:26004 ! phenylpropanoid relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:64477 ! monolignol relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17746 name: D-xylonate subset: chebi_ph7_3 is_a: CHEBI:27345 ! xylonate [Term] id: CHEBI:17747 name: bis(2-ethylhexyl) phthalate subset: chebi_ph7_3 is_a: CHEBI:35484 ! phthalate ester is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:77326 ! androstane receptor agonist relationship: has_role CHEBI:79056 ! plasticiser [Term] id: CHEBI:17748 name: thymidine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17750 name: glycine betaine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:24373 ! glycine derivative relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17751 name: dihydrostreptomycin 3'alpha,6-bisphosphate is_a: CHEBI:26787 ! streptomycin phosphate [Term] id: CHEBI:17752 name: N(6)-acetyl-L-lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine is_a: CHEBI:22193 ! acetyl-L-lysine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17754 name: glycerol subset: chebi_ph7_3 is_a: CHEBI:17522 ! alditol is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25728 ! osmolyte relationship: has_role CHEBI:27780 ! detergent relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:177543 name: terrein subset: chebi_ph7_3 is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:17755 name: cystathionine is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:23505 ! cystathionines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17756 name: (S)-mandelate subset: chebi_ph7_3 is_a: CHEBI:25147 ! mandelate [Term] id: CHEBI:17757 name: plastoquinone subset: chebi_ph7_3 is_a: CHEBI:35795 ! polyprenylbenzoquinone [Term] id: CHEBI:17759 name: cholesta-5,7-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138131 ! Delta(5),Delta(7)-sterol is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17760 name: methyl sulfate is_a: CHEBI:29281 ! alkyl sulfate is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:17761 name: ceramide subset: chebi_ph7_3 is_a: CHEBI:26739 ! sphingolipid is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:17762 name: 5alpha-cholestan-3-one subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:167166 ! 3-oxocholestane relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:17763 name: 4-methylumbelliferyl acetate subset: chebi_ph7_3 is_a: CHEBI:23403 ! coumarins is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17764 name: 2-C-methyl-D-erythritol 4-(dihydrogen phosphate) is_a: CHEBI:26980 ! tetritol phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17766 name: cyclohexane-1,3-dione subset: chebi_ph7_3 is_a: CHEBI:23478 ! cyclohexanedione is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:17767 name: D-mannonate subset: chebi_ph7_3 is_a: CHEBI:33526 ! mannonate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17768 name: N-acetylputrescine is_a: CHEBI:26406 ! N-substituted putrescine is_a: CHEBI:35414 ! N-monoacetylalkane-alpha,omega-diamine relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17769 name: 4-aminobutanal is_a: CHEBI:22497 ! aminobutanal is_a: CHEBI:27390 ! omega-aminoaldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17770 name: 1-hydroxy-2-(beta-D-glucosyloxy)-9,10-anthraquinone subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:37483 ! monohydroxyanthraquinone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:17771 name: trans-urocanate subset: chebi_ph7_3 is_a: CHEBI:27247 ! urocanate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17772 name: (S)-tetrahydrocolumbamine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:17773 name: D-ribonate subset: chebi_ph7_3 is_a: CHEBI:33527 ! ribonate [Term] id: CHEBI:17774 name: pimelate(1-) is_a: CHEBI:133773 ! pimelate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17775 name: 7,9-dihydro-1H-purine-2,6,8(3H)-trione subset: chebi_ph7_3 is_a: CHEBI:27226 ! uric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17778 name: 2-hydroxy-3-oxosuccinic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:17780 name: 5-hydroxy-L-tryptophan is_a: CHEBI:28171 ! 5-hydroxytryptophan is_a: CHEBI:47995 ! hydroxy-L-tryptophan is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17781 name: lumichrome subset: chebi_ph7_3 is_a: CHEBI:37324 ! 7,8-dimethylbenzo[g]pteridine-2,4-dione relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17782 name: 5-dehydro-4-deoxy-D-glucuronic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:17784 name: 2-amino-2-deoxy-D-gluconic acid is_a: CHEBI:33772 ! gluconic acid derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:177850 name: (10E,12Z)-9-Hydroperoxy-10,12-octadecadienoic acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:25627 ! octadecadienoic acid [Term] id: CHEBI:17786 name: N-acetyl-L-leucine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:25018 ! L-leucine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17789 name: dihydrochelirubine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:177898 name: omega-carboxy-(fatty acyl)-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:17790 name: methanol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:33292 ! fuel relationship: has_role CHEBI:48360 ! amphiprotic solvent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17791 name: obtusifoliol subset: chebi_ph7_3 is_a: CHEBI:138029 ! 14alpha-methyl steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:177917 name: phenolic steroid subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:177918 name: phenolic steroid 3-O-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:17792 name: organohalogen compound subset: chebi_ph7_3 is_a: CHEBI:33285 ! heteroorganic entity is_a: CHEBI:37578 ! halide [Term] id: CHEBI:17793 name: calycosin is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17794 name: 3-phospho-D-glyceric acid is_a: CHEBI:17050 ! 3-phosphoglyceric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17795 name: dihydroxyfumarate(2-) subset: chebi_ph7_3 is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:17796 name: L-idonate subset: chebi_ph7_3 is_a: CHEBI:33529 ! idonate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17797 name: aldehydo-D-ribose 5-phosphate is_a: CHEBI:78679 ! D-ribose 5-phosphate [Term] id: CHEBI:17798 name: L-gamma-glutamyl phosphate is_a: CHEBI:50164 ! gamma-glutamyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17799 name: 2-methyl-DL-serine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:134205 ! 2-methyl-D-serine relationship: has_part CHEBI:74819 ! 2-methyl-L-serine [Term] id: CHEBI:17800 name: O-phosphoviomycin is_a: CHEBI:37694 ! O-phospho peptide [Term] id: CHEBI:17801 name: 4-hydroxy-4-methyl-2-oxoglutaric acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:17802 name: pseudouridine subset: chebi_ph7_3 is_a: CHEBI:26366 ! pseudouridines relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17803 name: dehydro-D-arabinono-1,4-lactone is_a: CHEBI:37581 ! gamma-lactone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:17804 name: dyspropterin subset: chebi_ph7_3 is_a: CHEBI:22881 ! biopterins is_a: CHEBI:30436 ! tetrahydropterin relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:178049 name: Prostaglandin F1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:17805 name: D-erythro-1-(imidazol-4-yl)glycerol 3-phosphate is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:26706 ! sn-glycerol 3-phosphates relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17806 name: N-acetyl-beta-D-galactosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group [Term] id: CHEBI:17807 name: 3-(3,4-dihydroxyphenyl)lactic acid is_a: CHEBI:33566 ! catechols is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:17808 name: IDP is_a: CHEBI:24843 ! inosine phosphate is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17810 name: 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167497 ! 1-O-(alk-1-enyl)-2-acyl-sn-glycerolipid is_a: CHEBI:68489 ! alkyl,acyl-sn-glycero-3-phosphocholine is_a: CHEBI:76170 ! olefinic phospholipid is_a: CHEBI:78188 ! 1-(alk-1-enyl)-2-acyl-glycero-3-phosphocholine [Term] id: CHEBI:17811 name: 2,4,6/3,5-pentahydroxycyclohexanone subset: chebi_ph7_3 is_a: CHEBI:25881 ! pentahydroxycyclohexanone [Term] id: CHEBI:17813 name: 4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138031 ! Delta(14) steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17814 name: salicin subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:28749 ! aryl beta-D-glucoside is_a: CHEBI:33857 ! aromatic primary alcohol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor relationship: has_role CHEBI:50266 ! prodrug [Term] id: CHEBI:17815 name: 1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:17816 name: 1D-myo-inositol 1,4-bisphosphate is_a: CHEBI:25443 ! myo-inositol bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17817 name: CDP-4-dehydro-3,6-dideoxy-D-glucose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:17818 name: N-feruloyltyramine subset: chebi_ph7_3 is_a: CHEBI:27175 ! tyramines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17820 name: 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid is_a: CHEBI:33823 ! enol is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:17821 name: thymine subset: chebi_ph7_3 is_a: CHEBI:26432 ! pyrimidine nucleobase is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17822 name: serine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:24712 ! hydroxymethyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17823 name: calcitriol subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:24621 ! hormone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38807 ! calcium channel agonist relationship: has_role CHEBI:38808 ! calcium channel modulator relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:50748 ! antipsoriatic relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17824 name: propan-2-ol subset: chebi_ph7_3 is_a: CHEBI:167095 ! secondary fatty alcohol is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:17825 name: 7-methylguanosine 5'-phosphate(1+) is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:17826 name: methylarsonous acid subset: chebi_ph7_3 is_a: CHEBI:50017 ! arsonous acids is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:64909 ! poison relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17827 name: methyl-CoM is_a: CHEBI:23356 ! S-substituted coenzyme M [Term] id: CHEBI:17828 name: 2,3-dihydroxyindole subset: chebi_ph7_3 is_a: CHEBI:23781 ! dihydroxyindole [Term] id: CHEBI:17830 name: 7,8-diaminononanoate is_a: CHEBI:37022 ! amino-acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:17831 name: heparosan-N-sulfate D-glucuronic acid is_a: CHEBI:33886 ! glucuronic acids is_a: CHEBI:35721 ! heparan sulfates is_a: CHEBI:47952 ! D-glucopyranuronic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17832 name: 1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64590 ! monoalkyl-sn-glycero-3-phosphocholine is_a: CHEBI:76170 ! olefinic phospholipid [Term] id: CHEBI:17833 name: gentamycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic [Term] id: CHEBI:17835 name: 2-phospho-D-glyceric acid is_a: CHEBI:24344 ! 2-phosphoglyceric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17836 name: 4-aminobenzoate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:63473 ! aromatic amino-acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17837 name: D-tagatose 6-phosphate is_a: CHEBI:49094 ! tagatose 6-phosphate [Term] id: CHEBI:17838 name: (3S)-3-hydroxy-L-aspartate(2-) is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:17839 name: 7,8-dihydropteroate subset: chebi_ph7_3 is_a: CHEBI:38796 ! pteroates relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:1784 name: biphenyl-4-amine subset: chebi_ph7_3 is_a: CHEBI:22496 ! aminobiphenyl relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:17840 name: indoxyl subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:17842 name: trypanothione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:17843 name: transfer RNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:17844 name: 2-amino-3-oxobutanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:17845 name: 1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:17846 name: (S)-naringenin subset: chebi_ph7_3 is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:50202 ! naringenin relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77035 ! expectorant [Term] id: CHEBI:17847 name: p-cresol subset: chebi_ph7_3 is_a: CHEBI:25399 ! cresol relationship: has_role CHEBI:64584 ! uremic toxin relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17848 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:17849 name: glucarolactone is_a: CHEBI:37426 ! aldarolactone [Term] id: CHEBI:17850 name: beta-N-acetylneuraminyl-2,3-beta-D-galactosyl-1,3-(beta-N-acetylneuraminyl-2,6)-N-acetyl-D-galactosaminyl group is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group [Term] id: CHEBI:17852 name: homocitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:17853 name: S-acetylcysteamine is_a: CHEBI:51277 ! thioester [Term] id: CHEBI:17854 name: cyclohexanone subset: chebi_ph7_3 is_a: CHEBI:23482 ! cyclohexanones relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17855 name: triglyceride subset: chebi_ph7_3 is_a: CHEBI:47778 ! glyceride is_a: CHEBI:76579 ! triradylglycerol [Term] id: CHEBI:17856 name: glucuronoxylan 4-O-methyl-D-glucuronate is_a: CHEBI:33903 ! glucuronates [Term] id: CHEBI:17857 name: 4-methyl-5-(2-phosphonooxyethyl)thiazole is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:38418 ! 1,3-thiazoles relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17858 name: glutathione disulfide is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:35489 ! organic disulfide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17859 name: glutaric acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:17860 name: 6-phospho-2-dehydro-3-deoxy-D-galactonic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17861 name: 4-chlorobenzoate subset: chebi_ph7_3 is_a: CHEBI:23133 ! chlorobenzoate relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:17862 name: 3-dehydrosphinganine is_a: CHEBI:46966 ! 2-amino-1-hydroxyoctadecan-3-one relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17863 name: cellobiono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:17864 name: taurolithocholic acid sulfate is_a: CHEBI:16158 ! steroid sulfate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17865 name: 4-methyl-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:191201 ! branched-chain keto acid anion is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17866 name: digallate subset: chebi_ph7_3 is_a: CHEBI:36085 ! trihydroxybenzoate [Term] id: CHEBI:17867 name: UDP-2-acetamido-4-dehydro-2,6-dideoxy-beta-D-glucose is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:17868 name: 1-palmitoylglycerone 3-phosphate is_a: CHEBI:15835 ! 1-acylglycerone 3-phosphate [Term] id: CHEBI:17869 name: 6-hydroxyhexanoic acid is_a: CHEBI:194303 ! omega-hydroxy-medium-chain fatty acid is_a: CHEBI:35971 ! 6-hydroxy monocarboxylic acid is_a: CHEBI:59202 ! straight-chain fatty acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:17871 name: 3-hydroxypropanal subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:17872 name: 2-oxo-2H-pyran-4,6-dicarboxylic acid is_a: CHEBI:36197 ! pyrandicarboxylic acid [Term] id: CHEBI:17874 name: dihydrozeatin subset: chebi_ph7_3 is_a: CHEBI:17524 ! 6-alkylaminopurine relationship: has_role CHEBI:23530 ! cytokinin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17875 name: quercetin 3,3'-bissulfate is_a: CHEBI:26481 ! quercetin bissulfate is_a: CHEBI:27116 ! trihydroxyflavone [Term] id: CHEBI:17876 name: rifamycin B is_a: CHEBI:26580 ! rifamycins is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:17877 name: FADH2 is_a: CHEBI:24040 ! flavin adenine dinucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17878 name: 2-hydroxycyclohexan-1-one subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:17879 name: 4-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17881 name: 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2H)-one is_a: CHEBI:26414 ! pyridazinone is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:17882 name: UDP-N-acetylmuramic acid is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:17883 name: hydrogen chloride is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18140 ! hydrogen halide is_a: CHEBI:23117 ! chlorine molecular entity is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17884 name: N(2)-phenylacetyl-L-glutamine is_a: CHEBI:8087 ! N(2)-phenylacetylglutamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17885 name: CDP-glycerol is_a: CHEBI:35240 ! nucleotide-alditol [Term] id: CHEBI:17886 name: D-tagaturonate subset: chebi_ph7_3 is_a: CHEBI:33900 ! tagaturonate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17888 name: 6-phospho-beta-D-glucosyl-(1->4)-D-glucose is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:17889 name: isopyridoxal subset: chebi_ph7_3 is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38187 ! pyridinecarbaldehyde is_a: CHEBI:38196 ! hydroxymethylpyridine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17890 name: tryptophol subset: chebi_ph7_3 is_a: CHEBI:38467 ! indolyl alcohol relationship: has_role CHEBI:22676 ! auxin relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17891 name: donor is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:17892 name: L-rhamnulose 1-phosphate is_a: CHEBI:24964 ! deoxyketohexose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17893 name: (2R)-2-hydroxy monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:17895 name: L-tyrosine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:18186 ! tyrosine is_a: CHEBI:73690 ! erythrose 4-phosphate/phosphoenolpyruvate family amino acid is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:64416 ! EC 1.3.1.43 (arogenate dehydrogenase) inhibitor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:17897 name: L-rhamnulose subset: chebi_ph7_3 is_a: CHEBI:24965 ! deoxyketohexose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17898 name: all-trans-retinal subset: chebi_ph7_3 is_a: CHEBI:12777 ! vitamin A is_a: CHEBI:15035 ! retinal relationship: has_role CHEBI:67195 ! gap junctional intercellular communication inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17899 name: 7alpha-hydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17901 name: 6-O-acetyl-D-glucose subset: chebi_ph7_3 is_a: CHEBI:59475 ! 6-O-acyl-D-glucose [Term] id: CHEBI:179012 name: PA(18:1(9Z)/19:0) is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:17902 name: N-carbamoylputrescine is_a: CHEBI:26406 ! N-substituted putrescine [Term] id: CHEBI:17903 name: 4-(dimethylamino)azobenzene subset: chebi_ph7_3 is_a: CHEBI:22682 ! azobenzenes [Term] id: CHEBI:17905 name: coenzyme M is_a: CHEBI:29256 ! thiol is_a: CHEBI:33551 ! organosulfonic acid relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:17906 name: aminoacetone is_a: CHEBI:26292 ! propanones is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17907 name: styrene oxide subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:17913 name: streptidine 6-phosphate is_a: CHEBI:26613 ! scyllo-inositol phosphate [Term] id: CHEBI:17915 name: hexano-6-lactone subset: chebi_ph7_3 is_a: CHEBI:50239 ! epsilon-lactone [Term] id: CHEBI:17917 name: L-allysine is_a: CHEBI:17027 ! allysine is_a: CHEBI:22490 ! aminoadipate semialdehyde is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17919 name: 3-mercapto-2-mercaptomethylpropanoic acid is_a: CHEBI:23853 ! dithiol is_a: CHEBI:33576 ! sulfur-containing carboxylic acid [Term] id: CHEBI:17920 name: 3-methyleneoxindole subset: chebi_ph7_3 is_a: CHEBI:38459 ! oxindoles [Term] id: CHEBI:17922 name: fluoren-9-one subset: chebi_ph7_3 is_a: CHEBI:24057 ! fluoren-9-ones relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite [Term] id: CHEBI:17924 name: D-glucitol subset: chebi_ph7_3 is_a: CHEBI:30911 ! glucitol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50503 ! laxative relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:75325 ! cathartic relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77969 ! food humectant [Term] id: CHEBI:17925 name: alpha-D-glucose subset: chebi_ph7_3 is_a: CHEBI:4167 ! D-glucopyranose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17926 name: hydrogenobyrinic acid is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:17927 name: N(1)-acetylspermidine is_a: CHEBI:22204 ! acetylspermidine relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17928 name: 1-amino-1-deoxy-scyllo-inositol 4-phosphate is_a: CHEBI:26613 ! scyllo-inositol phosphate [Term] id: CHEBI:17929 name: N(omega),N(omega)-dimethyl-L-arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative is_a: CHEBI:86468 ! dimethylarginine relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor [Term] id: CHEBI:17931 name: N-hydroxy-2-acetamidofluorene subset: chebi_ph7_3 is_a: CHEBI:19432 ! 2-acetamidofluorenes [Term] id: CHEBI:17933 name: calcidiol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17934 name: pregnan-21-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:36886 ! 21-oxo steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:17935 name: octanal subset: chebi_ph7_3 is_a: CHEBI:12834 ! n-alkanal is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:142621 ! medium-chain fatty aldehyde relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:17936 name: 2-acyl-sn-glycero-3-phosphate is_a: CHEBI:17088 ! monoacyl-sn-glycerol 3-phosphate is_a: CHEBI:76631 ! 1-lysophosphatidic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17937 name: L-rhamnono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:26545 ! rhamnonolactone [Term] id: CHEBI:17938 name: 5alpha-ergosta-7,22-diene-3beta,5-diol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:38194 ! 5alpha-hydroxy steroid [Term] id: CHEBI:17939 name: puromycin is_a: CHEBI:26404 ! puromycins relationship: has_role CHEBI:25605 ! nucleoside antibiotic relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76891 ! EC 3.4.11.14 (cytosol alanyl aminopeptidase) inhibitor relationship: has_role CHEBI:76893 ! EC 3.4.14.2 (dipeptidyl-peptidase II) inhibitor [Term] id: CHEBI:17941 name: diisopropyl fluorophosphate subset: chebi_ph7_3 is_a: CHEBI:16648 ! dialkyl phosphate [Term] id: CHEBI:17942 name: D-allose 6-phosphate is_a: CHEBI:20902 ! allose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17943 name: (S)-2-O-sulfolactic acid is_a: CHEBI:48289 ! 2-O-sulfolactic acid [Term] id: CHEBI:17945 name: N-cyclohexylformamide subset: chebi_ph7_3 is_a: CHEBI:24079 ! formamides is_a: CHEBI:33654 ! alicyclic compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:17947 name: 3-dehydroquinic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17948 name: (+)-taxifolin subset: chebi_ph7_3 is_a: CHEBI:38747 ! taxifolin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:17950 name: beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:63415 ! glycodiaosylceramide is_a: CHEBI:79208 ! beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide relationship: has_part CHEBI:139098 ! alpha-D-galactosyl-(1->4)-beta-D-galactosyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17952 name: flavonol 3-O-[alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]s subset: chebi_ph7_3 is_a: CHEBI:26548 ! rhamnosylglucoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:17953 name: xanthopterin-B2 subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:26373 ! pteridines relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:17954 name: 1-alpha-D-galactosyl-sn-glycerol 3-phosphate is_a: CHEBI:24167 ! galactosylglycerol phosphate [Term] id: CHEBI:17955 name: 2'-deoxyribonucleoside diphosphate is_a: CHEBI:16862 ! nucleoside 5'-diphosphate [Term] id: CHEBI:17957 name: 5-(2-hydroxyethyl)-4-methylthiazole subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38418 ! 1,3-thiazoles relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17958 name: alkyl cinnamate subset: chebi_ph7_3 is_a: CHEBI:36087 ! cinnamate ester [Term] id: CHEBI:17959 name: oxidized Renilla luciferin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:38314 ! pyrazines is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:17960 name: 3-oxopropanoic acid is_a: CHEBI:26643 ! aldehydic acid [Term] id: CHEBI:17961 name: farnesyl triphosphate is_a: CHEBI:26203 ! polyprenol triphosphate [Term] id: CHEBI:17962 name: CDP-diacylglycerol is_a: CHEBI:35774 ! CDP-glycerols relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17964 name: pipecolic acid is_a: CHEBI:26148 ! piperidinemonocarboxylic acid [Term] id: CHEBI:17965 name: isoorientin is_a: CHEBI:38684 ! tetrahydroxyflavone is_a: CHEBI:83280 ! flavone C-glycoside relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48578 ! radical scavenger [Term] id: CHEBI:17966 name: cyclohexyl isocyanide subset: chebi_ph7_3 is_a: CHEBI:35353 ! isocyanide [Term] id: CHEBI:17967 name: urethane subset: chebi_ph7_3 is_a: CHEBI:23003 ! carbamate ester relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:17968 name: butyrate subset: chebi_ph7_3 is_a: CHEBI:78115 ! fatty acid anion 4:0 relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17969 name: sedoheptulose 1,7-bisphosphate is_a: CHEBI:35133 ! ketoheptose phosphate is_a: CHEBI:63403 ! sedoheptulose derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17970 name: N-acyl-D-mannosaminolactone subset: chebi_ph7_3 is_a: CHEBI:25167 ! mannosaminolactone [Term] id: CHEBI:17972 name: ribonucleoside triphosphate is_a: CHEBI:17326 ! nucleoside 5'-triphoshate [Term] id: CHEBI:17973 name: alpha-D-galactose 1-phosphate is_a: CHEBI:16326 ! alpha-D-hexose 1-phosphate is_a: CHEBI:37480 ! D-galactopyranose 1-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17975 name: 5,10-(methanylylidene)tetrahydromethanopterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:17976 name: ubiquinol subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17977 name: 1,4-benzosemiquinone subset: chebi_ph7_3 is_a: CHEBI:134225 ! 1,4-benzosemiquinones is_a: CHEBI:22730 ! benzosemiquinones [Term] id: CHEBI:17978 name: 5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:38182 ! monohydroxypyridine [Term] id: CHEBI:17979 name: aldehydo-L-xylose subset: chebi_ph7_3 is_a: CHEBI:65328 ! L-xylose [Term] id: CHEBI:17980 name: 3'-phospho-5'-adenylyl sulfate is_a: CHEBI:22251 ! adenosine bisphosphate is_a: CHEBI:37875 ! acyl sulfate is_a: CHEBI:64620 ! purine ribonucleoside bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17981 name: O-acetyl-L-serine is_a: CHEBI:22194 ! acetyl-L-serine is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:17982 name: 6-acetamido-3-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:17983 name: UDP-L-arabinose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:17984 name: acyl-CoA is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:37240 ! adenosine 3',5'-bisphosphate is_a: CHEBI:51277 ! thioester relationship: has_role CHEBI:62049 ! acyl donor [Term] id: CHEBI:17985 name: adenosine 3',5'-bismonophosphate is_a: CHEBI:22251 ! adenosine bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:17987 name: benzyl alcohol subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:17989 name: daphnin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:17990 name: 1-O-(indol-3-ylacetyl)-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:24821 ! indolyl carbohydrate is_a: CHEBI:64633 ! indoleacetic acid ester conjugate [Term] id: CHEBI:17992 name: sucrose subset: chebi_ph7_3 is_a: CHEBI:24407 ! glycosyl glycoside relationship: has_role CHEBI:25728 ! osmolyte relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:17993 name: 3-(3,4-dihydroxypyridinium-1-yl)-L-alanine is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:17994 name: D-ribose 1,5-bisphosphate is_a: CHEBI:35158 ! ribose bisphosphate [Term] id: CHEBI:17996 name: chloride subset: chebi_ph7_3 is_a: CHEBI:16042 ! halide anion is_a: CHEBI:33432 ! monoatomic chlorine relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:17997 name: dinitrogen subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:25362 ! elemental molecule is_a: CHEBI:33266 ! diatomic nitrogen relationship: has_role CHEBI:77974 ! food packaging gas relationship: has_role CHEBI:78017 ! food propellant [Term] id: CHEBI:17998 name: 4-methylpentanal subset: chebi_ph7_3 is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:1800 name: 4-chloro-2-methylphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:18000 name: aralkylamine is_a: CHEBI:22331 ! alkylamines is_a: CHEBI:64365 ! aralkylamino compound [Term] id: CHEBI:18002 name: (-)-secologanin subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26407 ! pyrans is_a: CHEBI:50274 ! secoiridoid glycoside is_a: CHEBI:51702 ! enoate ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18003 name: 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioic acid is_a: CHEBI:23022 ! carboxy-2-hydroxymuconate semialdehyde [Term] id: CHEBI:18004 name: D-hamamelose subset: chebi_ph7_3 is_a: CHEBI:33916 ! aldopentose [Term] id: CHEBI:18005 name: keto-phenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:26008 ! phenylpyruvate is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:75050 ! chromogenic compound relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18007 name: 3-[hydroxy(oxido)phosphoranyl]pyruvic acid is_a: CHEBI:26044 ! phosphinic acids [Term] id: CHEBI:18009 name: NADP(+) is_a: CHEBI:13390 ! NAD(P)(+) is_a: CHEBI:25523 ! NADP relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:18010 name: 3',4',5-trihydroxy-3,7-dimethoxyflavone is_a: CHEBI:23798 ! dimethoxyflavone is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50781 ! EC 1.3.1.22 [3-oxo-5alpha-steroid 4-dehydrogenase (NADP(+))] inhibitor [Term] id: CHEBI:18011 name: androstane-3alpha,17beta-diol subset: chebi_ph7_3 is_a: CHEBI:27727 ! androstane-3,17-diol is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid [Term] id: CHEBI:18012 name: fumaric acid is_a: CHEBI:22958 ! butenedioic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:64049 ! food acidity regulator relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:18013 name: 4-O-feruloyl-D-quinic acid is_a: CHEBI:26493 ! quinic acid is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:18014 name: CMP-3-deoxy-alpha-D-manno-octulosonic acid is_a: CHEBI:20878 ! CMP-sugar [Term] id: CHEBI:18015 name: oxidized Latia luciferin subset: chebi_ph7_3 is_a: CHEBI:17269 ! Latia luciferin is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:18016 name: 3',4',5-trihydroxy-3,6,7-trimethoxyflavone subset: chebi_ph7_3 is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:27124 ! trimethoxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:18019 name: L-lysine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:22658 ! aspartate family amino acid is_a: CHEBI:25094 ! lysine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18020 name: 4-trimethylammoniobutanal subset: chebi_ph7_3 is_a: CHEBI:22939 ! butanals relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18021 name: phosphoenolpyruvate is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:18022 name: thiocyanate subset: chebi_ph7_3 is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:36828 ! pseudohalide anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18023 name: sirohydrochlorin is_a: CHEBI:52582 ! isobacteriochlorins relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18024 name: D-galacturonic acid is_a: CHEBI:33830 ! galacturonic acid [Term] id: CHEBI:18025 name: 2-hydroxypropyl dihydrogen phosphate is_a: CHEBI:36949 ! hydroxyalkyl phosphate [Term] id: CHEBI:18026 name: 2,3-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:18027 name: (-)-aristolochene subset: chebi_ph7_3 is_a: CHEBI:36529 ! aristolochene [Term] id: CHEBI:18029 name: dihydromacarpine subset: chebi_ph7_3 is_a: CHEBI:38517 ! benzophenanthridine alkaloid [Term] id: CHEBI:18030 name: quercetin 3,4'-bissulfate is_a: CHEBI:26481 ! quercetin bissulfate is_a: CHEBI:27116 ! trihydroxyflavone [Term] id: CHEBI:18032 name: 4-amino-2-methyl-5-phosphooxymethylpyrimidine is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:38338 ! aminopyrimidine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18033 name: 2-formylphenylformamide subset: chebi_ph7_3 is_a: CHEBI:22698 ! benzaldehydes [Term] id: CHEBI:18034 name: 4-fumarylacetoacetate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18035 name: diglyceride subset: chebi_ph7_3 is_a: CHEBI:47778 ! glyceride is_a: CHEBI:76578 ! diradylglycerol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18036 name: triphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:15266 ! triphosphate ion is_a: CHEBI:33461 ! phosphorus oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18037 name: 3-oxolauric acid is_a: CHEBI:134416 ! 3-oxo fatty acid [Term] id: CHEBI:18038 name: GDP-L-galactose is_a: CHEBI:35245 ! GDP-galactose [Term] id: CHEBI:18039 name: N-phospho-L-lombricine is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:18040 name: erythro-5-hydroxy-L-lysine is_a: CHEBI:24661 ! hydroxy-L-lysine is_a: CHEBI:60175 ! 5-hydroxylysine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18041 name: (S)-lactaldehyde subset: chebi_ph7_3 is_a: CHEBI:18419 ! lactaldehyde relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18042 name: (S)-2,3-dihydrodipicolinic acid is_a: CHEBI:48052 ! 2,3-dihydrodipicolinic acid [Term] id: CHEBI:18043 name: ricinine subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:26416 ! pyridine alkaloid is_a: CHEBI:38183 ! pyridone [Term] id: CHEBI:18044 name: dialkyl ketone subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:18046 name: 4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde is_a: CHEBI:23022 ! carboxy-2-hydroxymuconate semialdehyde [Term] id: CHEBI:18047 name: dihydrolipoic acid is_a: CHEBI:59913 ! thio-fatty acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18048 name: DIMBOA subset: chebi_ph7_3 is_a: CHEBI:23445 ! cyclic hydroxamic acid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38131 ! lactol is_a: CHEBI:46969 ! benzoxazine relationship: has_role CHEBI:62215 ! allelochemical relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:180482 name: 1,2,4-triazole-3-carboxamide is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:35727 ! triazoles is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:18049 name: piperidine is_a: CHEBI:26151 ! piperidines is_a: CHEBI:32863 ! secondary amine is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:37949 ! azacycloalkane relationship: has_role CHEBI:22695 ! base relationship: has_role CHEBI:33893 ! reagent relationship: has_role CHEBI:35223 ! catalyst relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:180496 name: gamma-cadinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:22976 ! cadinene [Term] id: CHEBI:18050 name: L-glutamine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:24318 ! glutamine family amino acid is_a: CHEBI:28300 ! glutamine is_a: CHEBI:83813 ! proteinogenic amino acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18051 name: L-aspartic 4-semialdehyde is_a: CHEBI:26643 ! aldehydic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:18052 name: loganate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:18053 name: 1-aminocyclopropanecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:24002 ! ethylene releasers relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18054 name: diphthine is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:180543 name: (S)-2-hydroxymethylglutarate subset: chebi_ph7_3 is_a: CHEBI:58777 ! 2-hydroxymethylglutarate [Term] id: CHEBI:18056 name: N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:90400 ! alpha-D-GalNAc-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18057 name: vellosimine subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18058 name: oxamic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18059 name: lipid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:18060 name: 1-haloalkane subset: chebi_ph7_3 is_a: CHEBI:24469 ! haloalkane [Term] id: CHEBI:18062 name: 4-guanidinobutanamide is_a: CHEBI:22965 ! butanamides is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:18063 name: 2-O-acyl-3-O-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:141434 ! monoacyl-3-O-(beta-D-galactosyl)-sn-glycerol is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:63425 ! galactosylglycerol derivative [Term] id: CHEBI:18064 name: 3-hydroxyisobutyric acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:18065 name: deacetylcephalosporin C is_a: CHEBI:47879 ! 3-hydroxymethylcephalosporin [Term] id: CHEBI:18066 name: UDP-D-glucose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:18067 name: phylloquinone subset: chebi_ph7_3 is_a: CHEBI:26106 ! phylloquinones is_a: CHEBI:28384 ! vitamin K relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18070 name: cytochrome c is_a: CHEBI:4056 ! cytochrome relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18071 name: (methylthio)acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:18072 name: 5-hydroxyisouric acid subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18073 name: xanthoaphin is_a: CHEBI:51958 ! organic polycyclic compound is_a: CHEBI:59772 ! hemiketal [Term] id: CHEBI:18075 name: dTDP is_a: CHEBI:27001 ! thymidine phosphate is_a: CHEBI:37037 ! pyrimidine 2'-deoxyribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18077 name: dTTP is_a: CHEBI:27001 ! thymidine phosphate is_a: CHEBI:37043 ! pyrimidine 2'-deoxyribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18078 name: 2-dehydro-3-deoxy-L-rhamnonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:18080 name: 5-oxo-2,5-dihydro-2-furylacetic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid [Term] id: CHEBI:18081 name: 3-hexaprenyl-4,5-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18082 name: 1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose is_a: CHEBI:24183 ! galloyl beta-D-glucose is_a: CHEBI:37576 ! gallate ester relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18083 name: 1-methyladenine subset: chebi_ph7_3 is_a: CHEBI:25272 ! methyladenine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18084 name: testololactone subset: chebi_ph7_3 is_a: CHEBI:26616 ! seco-androstane is_a: CHEBI:26766 ! steroid lactone is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:18085 name: glycosaminoglycan is_a: CHEBI:22506 ! aminoglycan [Term] id: CHEBI:18086 name: indol-3-ylacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:24823 ! indoleacetaldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18087 name: myo-inositol polyphosphate is_a: CHEBI:25448 ! myo-inositol phosphate [Term] id: CHEBI:18088 name: formononetin is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:18089 name: N-benzoylglycine is_a: CHEBI:16180 ! N-acylglycine relationship: has_role CHEBI:64584 ! uremic toxin relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:18090 name: 3-aminopropanal is_a: CHEBI:26282 ! propanals is_a: CHEBI:27390 ! omega-aminoaldehyde [Term] id: CHEBI:180906 name: terpenoid phytoalexin is_a: CHEBI:26873 ! terpenoid relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:18091 name: asparagusic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:38336 ! dithiolanecarboxylic acid is_a: CHEBI:39192 ! dithiolanes [Term] id: CHEBI:180911 name: suramin(6-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:18092 name: 8'-apo-beta-carotenol subset: chebi_ph7_3 is_a: CHEBI:36783 ! apo carotenoid triterpenoid [Term] id: CHEBI:18093 name: 17,21-dihydroxy-5beta-pregnane-3,11,20-trione subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:23736 ! 4,5-dihydrocortisone [Term] id: CHEBI:18094 name: 1,4-dihydroxy-2-naphthoic acid is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:25483 ! naphthoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:51475 ! naphthohydroquinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18095 name: trans-4-hydroxy-L-proline is_a: CHEBI:20392 ! 4-hydroxyproline relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18096 name: N-acetylarylalkylamine subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:18098 name: CMP-N-glycoloyl-beta-neuraminic acid is_a: CHEBI:16788 ! CMP-N-acyl-beta-neuraminic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18099 name: cyclohexanol subset: chebi_ph7_3 is_a: CHEBI:23480 ! cyclohexanols is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:46787 ! solvent [Term] id: CHEBI:18100 name: multi-methyl-branched fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA [Term] id: CHEBI:18101 name: 4-hydroxyphenylacetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18102 name: O-octanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:73039 ! O-octanoylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18103 name: L-tyrosine methyl ester 4-sulfate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:37862 ! O-sulfoamino acid [Term] id: CHEBI:18104 name: 2-dehydro-3-deoxy-D-fuconic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:18106 name: deacetylipecoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:25248 ! methyl ester [Term] id: CHEBI:18107 name: xanthosine subset: chebi_ph7_3 is_a: CHEBI:142355 ! purines D-ribonucleoside is_a: CHEBI:48136 ! xanthosines relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18110 name: 3-phosphonatooxypyruvate(3-) subset: chebi_ph7_3 is_a: CHEBI:61693 ! carboxyalkyl phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18111 name: ribosomal RNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:18112 name: 2-aminophenol subset: chebi_ph7_3 is_a: CHEBI:28829 ! aminophenol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:18113 name: D-galactosyl-(1->3)-N-acetyl-beta-D-galactosamine subset: chebi_ph7_3 is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22484 ! galactosamine oligosaccharide [Term] id: CHEBI:18115 name: 4-hydroxymandelonitrile subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:18116 name: pseudouridine 5'-phosphate is_a: CHEBI:37040 ! C-nucleoside phosphate [Term] id: CHEBI:18117 name: 3-ADP-2-phosphoglyceric acid is_a: CHEBI:16515 ! 3-ADP-glyceric acid is_a: CHEBI:63455 ! tetronic acid derivative [Term] id: CHEBI:18118 name: L-xylono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:27347 ! xylonolactone [Term] id: CHEBI:18119 name: ethyl 3-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:78206 ! fatty acid ethyl ester [Term] id: CHEBI:18120 name: 5-aminopentanamide is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:18123 name: N-methylnicotinate subset: chebi_ph7_3 is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:35285 ! iminium betaine relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:18124 name: phosphonoacetaldehyde is_a: CHEBI:26069 ! phosphonic acids relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18125 name: trans-2-coumaric acid is_a: CHEBI:18176 ! 2-coumaric acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18126 name: S-acylglutathione is_a: CHEBI:17021 ! S-substituted glutathione is_a: CHEBI:22229 ! acylglutathione is_a: CHEBI:51277 ! thioester [Term] id: CHEBI:18127 name: cadaverine is_a: CHEBI:35411 ! alkane-alpha,omega-diamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:18128 name: luteolin 7-O-beta-D-glucosiduronic acid is_a: CHEBI:25091 ! luteolin O-glucuronoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18129 name: (S)-2-hydroxyoctadecanoic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:19660 ! 2-hydroxyoctadecanoic acid [Term] id: CHEBI:18130 name: (-)-5-oxo-1,2-campholide subset: chebi_ph7_3 is_a: CHEBI:66953 ! 5-oxo-1,2-campholide [Term] id: CHEBI:18131 name: licodione is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:71230 ! dihydrochalcones is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:18132 name: phosphocholine is_a: CHEBI:36700 ! phosphocholines relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18133 name: hexose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:18134 name: 3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:18135 name: catechol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:62215 ! allelochemical relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18136 name: 3-(2,3-dihydroxyphenyl)propanoic acid is_a: CHEBI:149591 ! (dihydroxyphenyl)propanoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18137 name: heparan sulfate alpha-D-glucosaminide is_a: CHEBI:24495 ! heparan alpha-D-glucosaminide is_a: CHEBI:35721 ! heparan sulfates relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18138 name: biuret subset: chebi_ph7_3 is_a: CHEBI:36954 ! condensed ureas [Term] id: CHEBI:18139 name: trimethylamine is_a: CHEBI:25274 ! methylamines is_a: CHEBI:32876 ! tertiary amine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:181399 name: (2S)-2-Amino-5-[[(1S,2R)-1-carboxy-2-hydroxybut-3-ynyl]amino]-5-oxopentanoic acid is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:18140 name: hydrogen halide subset: chebi_ph7_3 is_a: CHEBI:33405 ! hydracid relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:18142 name: N(6')-acetylkanamycin B is_a: CHEBI:28725 ! N(6')-acetylkanamycin [Term] id: CHEBI:18144 name: all-trans-nonaprenyl diphosphate is_a: CHEBI:53044 ! nonaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate [Term] id: CHEBI:18145 name: (R,R,R)-alpha-tocopherol subset: chebi_ph7_3 is_a: CHEBI:22470 ! alpha-tocopherol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:37700 ! EC 2.7.11.13 (protein kinase C) inhibitor relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:50855 ! antiatherogenic agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18146 name: (R)-canadine subset: chebi_ph7_3 is_a: CHEBI:22998 ! canadine [Term] id: CHEBI:18147 name: beta-maltose subset: chebi_ph7_3 is_a: CHEBI:17306 ! maltose relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:18148 name: alpha-D-glucose 1,6-bisphosphate is_a: CHEBI:17680 ! D-glucose 1,6-bisphosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18149 name: aureusidin subset: chebi_ph7_3 is_a: CHEBI:85970 ! hydroxyaurone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18150 name: 7-phospho-2-dehydro-3-deoxy-D-arabino-heptonic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18151 name: menaquinol subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:51475 ! naphthohydroquinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18152 name: myricetin is_a: CHEBI:24561 ! hexahydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50630 ! cyclooxygenase 1 inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:18153 name: ethene subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:18154 name: polysaccharide is_a: CHEBI:16646 ! carbohydrate is_a: CHEBI:167559 ! glycan is_a: CHEBI:33694 ! biomacromolecule [Term] id: CHEBI:18155 name: (S)-1,2-didecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:11152 ! 1,2-didecanoylglycerol is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:18157 name: aerobactin is_a: CHEBI:25095 ! L-lysine derivative relationship: has_role CHEBI:26672 ! siderophore relationship: has_role CHEBI:72316 ! virulence factor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18159 name: ribose 5-triphosphate is_a: CHEBI:26563 ! ribose triphosphate [Term] id: CHEBI:18163 name: alpha-NeuNAc-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-NeuNAc-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:75127 ! alpha-N-acetylneuraminyl-(2->3)-D-galactosyl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18164 name: (2S)-2-hydroxyphytanic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:24913 ! isoprenoid [Term] id: CHEBI:18165 name: isopenicillin N is_a: CHEBI:17334 ! penicillin [Term] id: CHEBI:18167 name: alpha-maltose subset: chebi_ph7_3 is_a: CHEBI:17306 ! maltose [Term] id: CHEBI:18168 name: 2-oxophytanic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:18169 name: 1D-myo-inositol 3-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18170 name: selenic acid is_a: CHEBI:33489 ! selenium oxoacid [Term] id: CHEBI:18171 name: 8-O-methylsterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins [Term] id: CHEBI:18172 name: fluoroacetate subset: chebi_ph7_3 is_a: CHEBI:85638 ! haloacetate(1-) [Term] id: CHEBI:18176 name: 2-coumaric acid is_a: CHEBI:23401 ! coumaric acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18177 name: N-acetylphenylethylamine subset: chebi_ph7_3 is_a: CHEBI:55469 ! N-acetyl-2-arylethylamine [Term] id: CHEBI:18179 name: phosphoinositide is_a: CHEBI:28874 ! phosphatidylinositol [Term] id: CHEBI:18183 name: 5-oxo-L-proline is_a: CHEBI:16010 ! 5-oxoproline is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18184 name: 3,5,3'-triiodothyropyruvic acid is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:18185 name: gamma-tocopherol subset: chebi_ph7_3 is_a: CHEBI:27013 ! tocopherol is_a: CHEBI:33234 ! vitamin E relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77962 ! food antioxidant relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18186 name: tyrosine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:33856 ! aromatic amino acid relationship: has_part CHEBI:50336 ! 4-hydroxybenzyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:18187 name: (E)-3,7,11,15-tetramethylhexadec-2-en-1-yl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:18188 name: (S)-3-aminoisobutyrate is_a: CHEBI:49096 ! 3-aminoisobutyrate [Term] id: CHEBI:18193 name: 10-deacetylbaccatin III subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:52557 ! tetracyclic diterpenoid [Term] id: CHEBI:18195 name: alpha,alpha'-trehalose 6,6'-bismycolate subset: chebi_ph7_3 is_a: CHEBI:27083 ! trehalose mycolate is_a: CHEBI:62547 ! polyacyl alpha,alpha-trehalose [Term] id: CHEBI:18197 name: ditrans,polycis-undecaprenyl diphosphate is_a: CHEBI:53042 ! undecaprenyl diphosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18198 name: 4-amino-4-deoxychorismic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid [Term] id: CHEBI:18199 name: UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine is_a: CHEBI:35257 ! UDP-glycopeptide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18200 name: isoscoparin is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18202 name: L-iditol subset: chebi_ph7_3 is_a: CHEBI:24766 ! iditol relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18203 name: penicillin N is_a: CHEBI:17334 ! penicillin [Term] id: CHEBI:18204 name: 16,17-didehydroprogesterone subset: chebi_ph7_3 is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:18205 name: alpha-D-mannose 1-phosphate is_a: CHEBI:16326 ! alpha-D-hexose 1-phosphate is_a: CHEBI:35374 ! D-mannose 1-phosphate [Term] id: CHEBI:18206 name: 2-amino-5-oxocyclohex-1-enecarbonyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:18207 name: N-acetyl-D-galactosamine 6-phosphate is_a: CHEBI:24154 ! galactosamine phosphate [Term] id: CHEBI:18208 name: benzylpenicillin is_a: CHEBI:17334 ! penicillin is_a: CHEBI:88187 ! penicillin allergen relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:18209 name: CoM-S-S-CoB is_a: CHEBI:23356 ! S-substituted coenzyme M is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:18210 name: hyponitrite(2-) is_a: CHEBI:33458 ! nitrogen oxoanion [Term] id: CHEBI:18211 name: citrulline is_a: CHEBI:23324 ! citrullines relationship: has_role CHEBI:59174 ! hapten relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:18212 name: selenite(2-) subset: chebi_ph7_3 is_a: CHEBI:33488 ! selenium oxoanion [Term] id: CHEBI:18215 name: syringetin is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:138732 ! 3',5'-dimethoxyflavone is_a: CHEBI:23798 ! dimethoxyflavone is_a: CHEBI:38684 ! tetrahydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor [Term] id: CHEBI:18216 name: alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18217 name: alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-D-GlcNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:18218 name: 2'-hydroxybiphenyl-2-sulfinate subset: chebi_ph7_3 is_a: CHEBI:37785 ! organosulfinate oxoanion [Term] id: CHEBI:18220 name: isoflavone subset: chebi_ph7_3 is_a: CHEBI:38757 ! isoflavones [Term] id: CHEBI:18222 name: xylose is_a: CHEBI:33916 ! aldopentose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18224 name: isoeugenol subset: chebi_ph7_3 is_a: CHEBI:195237 ! alkenylbenzene is_a: CHEBI:26004 ! phenylpropanoid relationship: has_role CHEBI:139492 ! sensitiser relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:18225 name: myo-inositol 1,3-bisphosphate is_a: CHEBI:25443 ! myo-inositol bisphosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18226 name: (R)-6-hydroxynicotine is_a: CHEBI:24729 ! 6-hydroxynicotine [Term] id: CHEBI:18227 name: sterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:18228 name: 1D-myo-inositol 1,3,4-trisphosphate is_a: CHEBI:25450 ! myo-inositol trisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18229 name: deacetoxycephalosporin C is_a: CHEBI:23066 ! cephalosporin [Term] id: CHEBI:18230 name: chlorophyll a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:28966 ! chlorophyll relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:18231 name: arsenic acid is_a: CHEBI:33407 ! arsenic oxoacid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18232 name: D-galactosamine 6-phosphate is_a: CHEBI:24154 ! galactosamine phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18233 name: xyloglucan is_a: CHEBI:37163 ! glucan is_a: CHEBI:61266 ! hemicellulose [Term] id: CHEBI:18234 name: alpha,alpha'-trehalose 6-mycolate subset: chebi_ph7_3 is_a: CHEBI:60486 ! trehalose monomycolate is_a: CHEBI:62546 ! monoacyl alpha,alpha-trehalose [Term] id: CHEBI:18236 name: 6-demethylsterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins [Term] id: CHEBI:18237 name: glutamic acid is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:50329 ! 2-carboxyethyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:18239 name: ditrans,polycis-decaprenyl diphosphate is_a: CHEBI:53043 ! decaprenyl diphosphate [Term] id: CHEBI:18240 name: 4-hydroxy-L-proline is_a: CHEBI:20392 ! 4-hydroxyproline is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:18241 name: 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:19257 ! 2'-deoxyribonucleoside monophosphate is_a: CHEBI:37016 ! 2'-deoxyribonucleoside 5'-phosphate [Term] id: CHEBI:18242 name: cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:18243 name: dopamine is_a: CHEBI:33567 ! catecholamine relationship: has_role CHEBI:35522 ! beta-adrenergic agonist relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:38147 ! cardiotonic drug relationship: has_role CHEBI:48560 ! dopaminergic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18244 name: 1-alkyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:138320 ! monoalkyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:18246 name: (1->4)-beta-D-glucan subset: chebi_ph7_3 is_a: CHEBI:28793 ! beta-D-glucan [Term] id: CHEBI:18247 name: 5-amino-6-(5-phospho-D-ribitylamino)uracil is_a: CHEBI:22295 ! alditol 5-phosphate is_a: CHEBI:22532 ! aminouracil is_a: CHEBI:26554 ! ribitol phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18248 name: iron atom subset: chebi_ph7_3 is_a: CHEBI:33356 ! iron group element atom relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18249 name: ergosta-5,7,22,24(28)-tetraen-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:18250 name: chondroitin 4'-sulfate is_a: CHEBI:37397 ! chondroitin sulfate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:182506 name: 8beta-Hydroxygermacrene A acid is_a: CHEBI:68588 ! germacrane sesquiterpenoid [Term] id: CHEBI:18251 name: UDP-D-galactofuranose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:18252 name: zymosterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18253 name: 5-guanidino-2-oxopentanoate is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:18254 name: ribonucleoside subset: chebi_ph7_3 is_a: CHEBI:33838 ! nucleoside is_a: CHEBI:47019 ! dihydroxytetrahydrofuran [Term] id: CHEBI:18255 name: nebularine subset: chebi_ph7_3 is_a: CHEBI:142355 ! purines D-ribonucleoside is_a: CHEBI:26399 ! purine ribonucleoside relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:18256 name: 4-formylbenzenesulfonic acid is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:18257 name: ornithine is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18258 name: 3,3',5-triiodo-L-thyronine is_a: CHEBI:24863 ! iodophenol is_a: CHEBI:24864 ! iodothyronine is_a: CHEBI:53291 ! 2-halophenol relationship: has_role CHEBI:60311 ! thyroid hormone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18259 name: N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide is_a: CHEBI:61360 ! globoside is_a: CHEBI:88167 ! N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide relationship: has_part CHEBI:142533 ! ->4)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_part CHEBI:142567 ! alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18261 name: N-carbamoyl-beta-alanine is_a: CHEBI:22823 ! beta-alanine derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18262 name: dodecanoate subset: chebi_ph7_3 is_a: CHEBI:194240 ! omega-methyl-medium-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion is_a: CHEBI:78119 ! fatty acid anion 12:0 relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18263 name: 1-(5-phospho-D-ribosyl)-ATP is_a: CHEBI:20629 ! 5-phosphoribosyl-ATP [Term] id: CHEBI:18265 name: 2-aminopteridin-4-ol subset: chebi_ph7_3 is_a: CHEBI:73184 ! 2-amino-4-hydroxypteridine [Term] id: CHEBI:18266 name: 1D-4-O-methyl-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:25270 ! methyl myo-inositols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18267 name: 5-oxo-4,5-dihydro-2-furylacetic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:18268 name: D-glucurono-6,3-lactone subset: chebi_ph7_3 is_a: CHEBI:24301 ! glucuronolactone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18269 name: (1->6)-alpha-D-glucan subset: chebi_ph7_3 is_a: CHEBI:22385 ! alpha-D-glucan [Term] id: CHEBI:18271 name: 2',3'-cyclic nucleotide is_a: CHEBI:23447 ! cyclic nucleotide [Term] id: CHEBI:18272 name: N(2)-formyl-N(1)-(5-phospho-D-ribosyl)glycinamide is_a: CHEBI:24367 ! glycinamide ribonucleotide(2-) [Term] id: CHEBI:18274 name: 2'-deoxyribonucleoside subset: chebi_ph7_3 is_a: CHEBI:23636 ! deoxyribonucleoside is_a: CHEBI:47018 ! monohydroxytetrahydrofuran [Term] id: CHEBI:18276 name: dihydrogen subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:25362 ! elemental molecule is_a: CHEBI:33260 ! elemental hydrogen relationship: has_role CHEBI:15022 ! electron donor relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33292 ! fuel relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:77974 ! food packaging gas [Term] id: CHEBI:18277 name: N-(5-phosphonato-beta-D-ribosyl)anthranilate subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:18278 name: N-acetyl-D-glucosaminyldiphosphodolichol is_a: CHEBI:24274 ! glucosaminylphosphodolichol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18280 name: phenylglyoxylic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:18281 name: 2,5-didehydro-D-gluconic acid is_a: CHEBI:33507 ! diketoaldonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18282 name: nucleobase is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:18283 name: alpha,alpha-trehalose 6-phosphate is_a: CHEBI:27084 ! trehalose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18284 name: thiamine(1+) triphosphate(1-) is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:18285 name: (S)-stylopine subset: chebi_ph7_3 is_a: CHEBI:194528 ! an (S)-7,8,13,14-tetrahydroprotoberberine is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:51914 ! organic heterohexacyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18287 name: L-fucose is_a: CHEBI:33984 ! fucose relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18288 name: (S)-2-hydroxypropyl-CoM is_a: CHEBI:24744 ! 2-hydroxypropyl-CoM [Term] id: CHEBI:18289 name: quinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:18291 name: manganese atom subset: chebi_ph7_3 is_a: CHEBI:33352 ! manganese group element atom relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18292 name: jasmonic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid relationship: has_role CHEBI:24937 ! jasmonates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18293 name: 5-methoxypsoralen subset: chebi_ph7_3 is_a: CHEBI:26369 ! psoralens is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:52061 ! 5-methoxyfurocoumarin relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18295 name: histamine is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:64365 ! aralkylamino compound relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:182951 name: 4alpha-Carboxy-stigmasta-7,24(24(1))-dien-3beta-ol is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:18296 name: chondroitin 6'-sulfate is_a: CHEBI:37397 ! chondroitin sulfate [Term] id: CHEBI:18297 name: 1D-myo-inositol 1-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18298 name: 3-hydroxy-2-methyl-3-phytyl-2,3-dihydro-1,4-naphthoquinone subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26106 ! phylloquinones [Term] id: CHEBI:18299 name: 1-C-(indol-3-yl)glycerol 3-phosphate is_a: CHEBI:26706 ! sn-glycerol 3-phosphates [Term] id: CHEBI:18300 name: maleic acid is_a: CHEBI:22958 ! butenedioic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18301 name: (2Z,4E)-4-hydroxymuconic semialdehyde is_a: CHEBI:145078 ! 3-oxo aldehyde is_a: CHEBI:38436 ! muconic semialdehyde is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:18302 name: 1-(5-phospho-beta-D-ribosyl)-5-[(5-phospho-beta-D-ribosylamino)methylideneamino]imidazole-4-carboxamide is_a: CHEBI:37290 ! 1-(phosphoribosyl)imidazolecarboxamide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18303 name: phosphatidyl-L-serine is_a: CHEBI:52565 ! acylglycerophosphoserine is_a: CHEBI:60971 ! aminophospholipid is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18304 name: deamido-NAD(+) is_a: CHEBI:37584 ! nicotinic acid dinucleotide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18305 name: hydroquinone O-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18306 name: thiamine(1+) carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26948 ! vitamin B1 relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:18307 name: UDP-D-galactose is_a: CHEBI:17297 ! UDP-sugar relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18308 name: acrylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:183086 name: (omega-1)-methyl-3-oxo-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:183096 name: (Z)-progoitrin(1-) subset: chebi_ph7_3 is_a: CHEBI:183098 ! (Z)-glucosinolate(1-) is_a: CHEBI:8454 ! progoitrin(1-) [Term] id: CHEBI:183098 name: (Z)-glucosinolate(1-) subset: chebi_ph7_3 is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:18310 name: alkane subset: chebi_ph7_3 is_a: CHEBI:24632 ! hydrocarbon is_a: CHEBI:33653 ! aliphatic compound [Term] id: CHEBI:18311 name: quinoline-4-carboxylic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid [Term] id: CHEBI:18312 name: 4-(hydroxymethyl)benzenesulfonic acid is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:18313 name: alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:36508 ! glycotriaosylceramide relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18314 name: L-2-aminopentanoic acid is_a: CHEBI:19475 ! 2-aminopentanoic acid relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:18315 name: pyrroloquinoline quinone is_a: CHEBI:25622 ! orthoquinones is_a: CHEBI:26461 ! pyrroloquinoline cofactor is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:27314 ! water-soluble vitamin (role) relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:18316 name: 4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol subset: chebi_ph7_3 is_a: CHEBI:38170 ! diamino-1,3,5-triazine is_a: CHEBI:38172 ! monohydroxy-1,3,5-triazine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:18317 name: N-acetyl-LL-2,6-diaminopimelate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:18318 name: galactosylceramide sulfate is_a: CHEBI:36477 ! sulfoglycosphingolipid is_a: CHEBI:36498 ! galactosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18319 name: SAICAR is_a: CHEBI:37290 ! 1-(phosphoribosyl)imidazolecarboxamide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18320 name: 1,4-dithiothreitol subset: chebi_ph7_3 is_a: CHEBI:23853 ! dithiol is_a: CHEBI:25189 ! 1,4-dimercaptobutane-2,3-diol relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:63247 ! reducing agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18321 name: 1-(sn-glycero-3-phospho)-1D-myo-inositol is_a: CHEBI:26706 ! sn-glycerol 3-phosphates is_a: CHEBI:84140 ! myo-inositol monophosphate derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18322 name: 6-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:71944 ! aldehydic acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:18323 name: anserine is_a: CHEBI:22823 ! beta-alanine derivative is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:183235 name: 2''-O-crotonyl-ADP-D-ribose subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:183249 name: lysophosphatidylinositol 16:0 is_a: CHEBI:64931 ! lysophosphatidyl-1D-myo-inositol [Term] id: CHEBI:18325 name: 2-succinatobenzoate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:183252 name: lysophosphatidylserine 16:0 is_a: CHEBI:68510 ! lysophosphatidylserine [Term] id: CHEBI:183253 name: lysophosphatidylserine 18:0 is_a: CHEBI:68510 ! lysophosphatidylserine [Term] id: CHEBI:183255 name: lysophosphatidylserine 18:1 is_a: CHEBI:68510 ! lysophosphatidylserine [Term] id: CHEBI:18327 name: N-formimidoyl-L-glutamate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18328 name: 13-hydroxylupanine is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:18329 name: 5alpha-androstane-3beta,17beta-diol subset: chebi_ph7_3 is_a: CHEBI:27727 ! androstane-3,17-diol is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:18330 name: isovitexin is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor [Term] id: CHEBI:18332 name: L-thyroxine is_a: CHEBI:24863 ! iodophenol is_a: CHEBI:30660 ! thyroxine is_a: CHEBI:53291 ! 2-halophenol is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84144 ! L-phenylalanine derivative relationship: has_role CHEBI:50671 ! antithyroid drug relationship: has_role CHEBI:60311 ! thyroid hormone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18333 name: D-arabinitol subset: chebi_ph7_3 is_a: CHEBI:22605 ! arabinitol [Term] id: CHEBI:18334 name: adenosine 5'-(pentahydrogen tetraphosphate) is_a: CHEBI:37067 ! purine ribonucleoside 5'-tetraphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:18335 name: pyridoxamine 5'-phosphate is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:36970 ! vitamin B6 phosphate is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38198 ! aminoalkylpyridine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18336 name: 4-(phosphonooxy)-L-threonine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:84189 ! L-threonine derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18337 name: 5-amino-6-(5-phospho-beta-D-ribosylamino)uracil is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:22532 ! aminouracil is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18340 name: cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:36104 ! 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid [Term] id: CHEBI:18341 name: diacetylchitobiosyldiphosphodolichol is_a: CHEBI:23102 ! chitobiosyldiphosphodolichol [Term] id: CHEBI:18344 name: kynurenic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid is_a: CHEBI:38775 ! monohydroxyquinoline relationship: has_role CHEBI:48878 ! nicotinic antagonist relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:70998 ! G-protein-coupled receptor agonist relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18346 name: vanillin subset: chebi_ph7_3 is_a: CHEBI:22698 ! benzaldehydes is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18347 name: L-norleucine is_a: CHEBI:36405 ! 2-aminohexanoic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:18348 name: 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate is_a: CHEBI:37328 ! phosphatidylinositol bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18349 name: N(1)-(5-phospho-D-ribosyl)glycinamide is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18350 name: isoquinolin-1(2H)-one subset: chebi_ph7_3 is_a: CHEBI:24922 ! isoquinolines [Term] id: CHEBI:183508 name: methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:183509 ! branched-chain fatty acyl-CoA(4-) [Term] id: CHEBI:183509 name: branched-chain fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:18351 name: 4-hydroxyhexan-3-one subset: chebi_ph7_3 is_a: CHEBI:24573 ! hexanone is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:183510 name: 2-methylacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:183511 name: 2-methylacyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA [Term] id: CHEBI:18353 name: vanillyl alcohol subset: chebi_ph7_3 is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:22743 ! benzyl alcohols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18354 name: (R)-2-hydroxypropyl-CoM is_a: CHEBI:24744 ! 2-hydroxypropyl-CoM [Term] id: CHEBI:18355 name: 2-hydroxypenta-2,4-dienoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:18356 name: pyrroloquinoline quinol is_a: CHEBI:26461 ! pyrroloquinoline cofactor is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:18357 name: (R)-noradrenaline is_a: CHEBI:33569 ! noradrenaline relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35569 ! alpha-adrenergic agonist relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18358 name: methoxsalen subset: chebi_ph7_3 is_a: CHEBI:26369 ! psoralens is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:50684 ! cross-linking reagent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18359 name: holo-[acyl-carrier protein] subset: chebi_ph7_3 is_a: CHEBI:13534 ! acyl-carrier protein relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18360 name: 13-(2-methylcrotonoyloxy)lupanine is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:18361 name: diphosphate(4-) is_a: CHEBI:35782 ! diphosphate ion [Term] id: CHEBI:18362 name: 17-O-deacetylvindoline is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27288 ! vinca alkaloid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:18363 name: reticulinylium subset: chebi_ph7_3 is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:18364 name: 14-demethyllanosterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18365 name: naphthalene-1,3,6,8-tetrol subset: chebi_ph7_3 is_a: CHEBI:26925 ! naphthalenetetrol [Term] id: CHEBI:18366 name: Arg-tRNA(Arg) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18367 name: phosphate(3-) is_a: CHEBI:35780 ! phosphate ion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:18368 name: D-glucosyl-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:36500 ! glucosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18370 name: 7-deoxyloganin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:51737 ! alpha,beta-unsaturated carboxylic ester [Term] id: CHEBI:18371 name: cis-4-carboxymethylenebut-2-en-4-olide is_a: CHEBI:11972 ! 4-carboxymethylenebut-2-en-4-olide [Term] id: CHEBI:18372 name: 7,8-dihydroneopterin 3'-triphosphate is_a: CHEBI:25500 ! neopterins is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18373 name: (7S)-salutaridinol is_a: CHEBI:26600 ! salutaridinol [Term] id: CHEBI:18374 name: 1-(5-phospho-beta-D-ribosyl)-5'-AMP is_a: CHEBI:20853 ! AMP-sugar relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18375 name: nucleoside 3',5'-cyclic phosphate is_a: CHEBI:23447 ! cyclic nucleotide [Term] id: CHEBI:18376 name: dermatan sulfate is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37395 ! mucopolysaccharide relationship: has_role CHEBI:50248 ! hematologic agent relationship: has_role CHEBI:50249 ! anticoagulant [Term] id: CHEBI:18377 name: N-formylkynurenine is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:18378 name: 4alpha-methyl-5alpha-cholest-7-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:18379 name: nitrile subset: chebi_ph7_3 is_a: CHEBI:23424 ! cyanides relationship: has_part CHEBI:48819 ! cyano group [Term] id: CHEBI:183799 name: CE(18:2) subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:18380 name: 2,3,2',3'-tetrakis(3-hydroxytetradecanoyl)-alpha-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate is_a: CHEBI:25051 ! lipid As relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:183800 name: CE(18:1) subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester [Term] id: CHEBI:183806 name: 7beta-hydroxypregnenolone subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite [Term] id: CHEBI:18381 name: 5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide is_a: CHEBI:37290 ! 1-(phosphoribosyl)imidazolecarboxamide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18383 name: 3-aminoalanine is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:35987 ! diamino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18384 name: 1D-myo-inositol 4-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:18385 name: thiamine(1+) subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26948 ! vitamin B1 relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18386 name: quinaldic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18387 name: N-formimidoyl-L-aspartate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:18388 name: apigenin is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:18390 name: N-acyl-beta-D-galactosylsphingosine subset: chebi_ph7_3 is_a: CHEBI:143593 ! beta-galactosylceramide is_a: CHEBI:83866 ! N-acyl-D-galactosylsphingosine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18391 name: D-gluconate subset: chebi_ph7_3 is_a: CHEBI:24265 ! gluconate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18392 name: bis(beta-glucosyluronic acid)bilirubin is_a: CHEBI:22872 ! (glucosyluronic acid)bilirubin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18393 name: naphthalene-1,3,8-triol subset: chebi_ph7_3 is_a: CHEBI:27118 ! naphthalenetriol [Term] id: CHEBI:18394 name: 6-O-alpha-D-glucopyranosyl-D-fructofuranose subset: chebi_ph7_3 is_a: CHEBI:35378 ! glycosylfructose relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18395 name: 2-dehydropantolactone subset: chebi_ph7_3 is_a: CHEBI:47022 ! tetrahydrofurandione [Term] id: CHEBI:18396 name: beta-D-mannosyldiacetylchitobiosyldiphosphodolichol is_a: CHEBI:18341 ! diacetylchitobiosyldiphosphodolichol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18397 name: 2-phenylethylamine is_a: CHEBI:18000 ! aralkylamine is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:50048 ! phenylethylamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18398 name: linear maltodextrin subset: chebi_ph7_3 is_a: CHEBI:25140 ! maltodextrin [Term] id: CHEBI:183983 name: 1-palmitoyl-2-azelaoylphosphatidylcholine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:18399 name: codeinone is_a: CHEBI:24921 ! isoquinoline alkaloid [Term] id: CHEBI:18400 name: 2-hydroxy-1,4-benzoquinone is_a: CHEBI:67273 ! monohydroxy-1,4-benzoquinones relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18401 name: phenylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18402 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47891 ! steroid acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18403 name: L-arabinitol subset: chebi_ph7_3 is_a: CHEBI:22605 ! arabinitol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18404 name: 3-methylcatechol subset: chebi_ph7_3 is_a: CHEBI:25289 ! methylcatechol relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:18405 name: pyridoxal 5'-phosphate is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:36970 ! vitamin B6 phosphate is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38187 ! pyridinecarbaldehyde relationship: has_role CHEBI:131699 ! EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18406 name: AICA ribonucleotide is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:37290 ! 1-(phosphoribosyl)imidazolecarboxamide relationship: has_role CHEBI:35554 ! cardiovascular drug relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18407 name: hydrogen cyanide subset: chebi_ph7_3 is_a: CHEBI:33405 ! hydracid is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:64909 ! poison relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18408 name: cobamamide subset: chebi_ph7_3 is_a: CHEBI:23334 ! cobalamins is_a: CHEBI:33913 ! corrinoid relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18409 name: (2S)-2-hydroxy-2-methyl-3-oxobutanoic acid is_a: CHEBI:16444 ! 2-acetyllactic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18410 name: N-formylanthranilate subset: chebi_ph7_3 is_a: CHEBI:61666 ! amidobenzoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18411 name: laminarabiose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:18412 name: N(omega)-phospho-L-arginine is_a: CHEBI:26051 ! phosphoamino acid is_a: CHEBI:64618 ! phosphagen is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:184125 name: PS(16:0/0:0) is_a: CHEBI:52603 ! 1-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:18413 name: 2-formamido-N(1)-(5-phospho-D-ribosyl)acetamidine is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:35359 ! carboxamidine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18415 name: N-formimidoylglycine is_a: CHEBI:24373 ! glycine derivative [Term] id: CHEBI:18416 name: N-[(R)-pantothenoyl]-L-cysteine is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18417 name: (RS)-coclaurine is_a: CHEBI:23347 ! coclaurine [Term] id: CHEBI:18418 name: (RS)-norcoclaurine is_a: CHEBI:25591 ! norcoclaurine [Term] id: CHEBI:18419 name: lactaldehyde subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:50413 ! hydroxyaldehyde relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:18420 name: magnesium(2+) subset: chebi_ph7_3 is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:39127 ! magnesium cation is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:18421 name: superoxide subset: chebi_ph7_3 is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:33263 ! diatomic oxygen is_a: CHEBI:36876 ! inorganic radical anion is_a: CHEBI:61073 ! oxygen radical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18422 name: sulfur dioxide subset: chebi_ph7_3 is_a: CHEBI:48154 ! sulfur oxide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:78003 ! food bleaching agent relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:18425 name: 2-C-methyl-D-erythritol 2,4-cyclic diphosphate is_a: CHEBI:26980 ! tetritol phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:18426 name: 1D-myo-inositol 1,2-cyclic phosphate is_a: CHEBI:25444 ! myo-inositol cyclic phosphate relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:18427 name: 1D-1-O-methyl-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:25270 ! methyl myo-inositols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18429 name: dehydrovomifoliol subset: chebi_ph7_3 is_a: CHEBI:36739 ! fenchane monoterpenoid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:18430 name: 3-hydroxy-16-methoxy-2,3-dihydrotabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid [Term] id: CHEBI:184300 name: ADP-2'-imine-ribofurano[1',2':4,5]oxazolidine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:18431 name: 7alpha,26-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:27136 ! triol is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18435 name: (+)-7-isojasmonic acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:61121 ! oxylipin relationship: has_role CHEBI:24937 ! jasmonates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:184361 name: (2-\{[hydroxy(\{[(2S,3R,4E)-3-hydroxy-2-[(1-hydroxytetracosylidene)amino]octadec-4-en-1-yl]oxy})phosphoryl]oxy}ethyl)trimethylazanium is_a: CHEBI:35786 ! phosphosphingolipid [Term] id: CHEBI:184376 name: streptidine(2+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:184381 name: bacitracin A zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:1845 name: 4-hydroxy-3-polyprenylbenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:18450 name: (R)-mandelonitrile subset: chebi_ph7_3 is_a: CHEBI:16910 ! mandelonitrile [Term] id: CHEBI:184744 name: (2-\{[hydroxy(\{[(2S,3R)-3-hydroxy-2-[(1-hydroxyhexadecylidene)amino]octadecyl]oxy})phosphoryl]oxy}ethyl)trimethylazanium is_a: CHEBI:35786 ! phosphosphingolipid [Term] id: CHEBI:18481 name: (-)-cis-sabinol subset: chebi_ph7_3 is_a: CHEBI:26590 ! sabinol [Term] id: CHEBI:18504 name: (1->3,1->4)-beta-D-glucan is_a: CHEBI:28793 ! beta-D-glucan [Term] id: CHEBI:18515 name: (1S,2S,4R)-limonene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:17219 ! limonene-1,2-diol is_a: CHEBI:25040 ! limonene monoterpenoid [Term] id: CHEBI:18533 name: 5alpha-campestan-3-one subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:22921 ! brassinosteroid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:18534 name: campest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:18608 name: (6S)-5-methyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:189667 ! 5-methyltetrahydrofolate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18634 name: (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde is_a: CHEBI:25422 ! muconate semialdehyde [Term] id: CHEBI:18657 name: (R)-2-trans-abscisic acid is_a: CHEBI:62426 ! 2-trans-abscisic acid [Term] id: CHEBI:18697 name: (R)-pantoic acid is_a: CHEBI:14737 ! pantoic acid [Term] id: CHEBI:18703 name: D-pipecolate is_a: CHEBI:36110 ! pipecolate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:18723 name: nicotine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:17688 ! (S)-nicotine relationship: has_part CHEBI:39162 ! (R)-nicotine relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35474 ! anxiolytic drug relationship: has_role CHEBI:47958 ! nicotinic acetylcholine receptor agonist relationship: has_role CHEBI:49110 ! peripheral nervous system drug relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:52290 ! mitogen relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:18743 name: (S)-2-trans-abscisic acid is_a: CHEBI:62426 ! 2-trans-abscisic acid [Term] id: CHEBI:18790 name: (S)-mevalonate subset: chebi_ph7_3 is_a: CHEBI:194520 ! 3,5-dihydroxy-3-methylpentanoate [Term] id: CHEBI:188092 name: Lyso-PAF C-16-d4 is_a: CHEBI:78196 ! monoalkylglycerophosphocholine [Term] id: CHEBI:18822 name: (Z,Z,Z)-geranylgeraniol subset: chebi_ph7_3 is_a: CHEBI:24229 ! geranylgeraniol [Term] id: CHEBI:1883 name: 4-hydroxystyrene subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:188358 name: (S)-2-benzylsuccinate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:57621 ! 2-benzylsuccinate(2-) [Term] id: CHEBI:188445 name: 2-oxindole-3-acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:188470 name: N(6)-methyl,N(6)-L-threonylcarbamoyladenosine 5'-phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:18859 name: 1,2,3-tribromopropane subset: chebi_ph7_3 is_a: CHEBI:22926 ! bromohydrocarbon is_a: CHEBI:22929 ! bromoalkane [Term] id: CHEBI:18887 name: cyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:188889 name: 5-Ethyl-2-methyl-4-oxo-4,5-dihydro-3-furanolate is_a: CHEBI:26912 ! oxolanes [Term] id: CHEBI:188921 name: C28-steroid subset: chebi_ph7_3 is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:188922 name: (22S)-22-hydroxy C28-steroid subset: chebi_ph7_3 is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:36863 ! 22-hydroxy steroid [Term] id: CHEBI:188923 name: C29-steroid subset: chebi_ph7_3 is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:188998 name: alpha-D-xylulofuranose subset: chebi_ph7_3 is_a: CHEBI:144889 ! D-xylulofuranose [Term] id: CHEBI:188999 name: dopaminechrome (enol form) is_a: CHEBI:24829 ! indolones is_a: CHEBI:33823 ! enol is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:189002 name: dopaminechrome (keto form) subset: chebi_ph7_3 is_a: CHEBI:24793 ! indoledione is_a: CHEBI:25622 ! orthoquinones relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:18904 name: (3R,6R)-1,3,4,6-tetrachlorocyclohexa-1,4-diene subset: chebi_ph7_3 is_a: CHEBI:513 ! 1,3,4,6-tetrachlorocyclohexa-1,4-diene [Term] id: CHEBI:189064 name: phytochromobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:189095 name: conidiogenone subset: chebi_ph7_3 is_a: CHEBI:177332 ! carbotetracyclic compound is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:189099 name: 1D-myo-inositol 3,4,6-trisphosphate(6-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:18913 name: (1->3)-alpha-D-mannooligosaccharide is_a: CHEBI:25174 ! mannooligosaccharide [Term] id: CHEBI:18918 name: 1,3-dichloropropene is_a: CHEBI:23162 ! chloropropene relationship: has_role CHEBI:25491 ! nematicide [Term] id: CHEBI:18946 name: delta-lactone is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:1895 name: 4-methylbenzyl alcohol subset: chebi_ph7_3 is_a: CHEBI:25281 ! methylbenzyl alcohol relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:189546 name: alpha-Neu5Ac-(2->3)-beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer is_a: CHEBI:36642 ! glycohexaosylceramide is_a: CHEBI:61360 ! globoside relationship: has_role CHEBI:144829 ! tumour antigen [Term] id: CHEBI:189554 name: S-[(2E,6E,10E)-geranylgeranyl]-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:137935 ! S-polyprenyl-L-cysteine zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:189572 name: 2''-O-lipoyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) [Term] id: CHEBI:189573 name: 2''-O-biotinyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) [Term] id: CHEBI:189642 name: alpha-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:58720 ! D-glucopyranuronate [Term] id: CHEBI:189667 name: 5-methyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:20612 ! 5-methyltetrahydrofolate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:189673 name: 2''-O-hexadecanoyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) [Term] id: CHEBI:189674 name: 2''-O-tetradecanoyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) [Term] id: CHEBI:189697 name: (2Z,4E)-2-aminomuconic acid is_a: CHEBI:16886 ! 2-aminomuconic acid [Term] id: CHEBI:189700 name: 2-aminomuconate is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:189703 name: 1-stearoyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:189710 name: stearoyl-L-carnitine is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:189823 name: hydroperoxydocosapentaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:189831 name: hydroperoxydocosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:189832 name: hydroperoxy polyunsaturated fatty acid is_a: CHEBI:194321 ! hydroperoxy unsaturated fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:189840 name: dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:189846 name: dicarboxylic fatty acid dianion is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:189847 name: phthiocerol derivatives is_a: CHEBI:18059 ! lipid [Term] id: CHEBI:189854 name: N(6)-(fatty acyl)-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue [Term] id: CHEBI:189868 name: Met-enkephalin zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:190012 name: 3-(alpha-D-6-sulfoquinovosyl)-sn-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:190135 name: di-mu-sulfido-diiron subset: chebi_ph7_3 is_a: CHEBI:49601 ! Fe2S2 iron-sulfur cluster [Term] id: CHEBI:19029 name: 1-aminopropan-2-yl phosphate is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:19030 name: 1-aminopropan-2-ol is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:190300 name: inorganic phosphate salt is_a: CHEBI:167164 ! mineral nutrient is_a: CHEBI:24839 ! inorganic salt is_a: CHEBI:37853 ! phosphate salt [Term] id: CHEBI:190529 name: phosphatidylinositol 34:0 is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:19062 name: 1-methylguanosine subset: chebi_ph7_3 is_a: CHEBI:25307 ! methylguanosine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:190689 name: Leu-enkephalin zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:190692 name: substance P(3+) subset: chebi_ph7_3 is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:190711 name: epoxy fatty acid anion is_a: CHEBI:190712 ! epoxy monocarboxylic acid anion [Term] id: CHEBI:190712 name: epoxy monocarboxylic acid anion is_a: CHEBI:32955 ! epoxide is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:190744 name: dihydrodemethylsterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:19092 name: 1-pyrroline is_a: CHEBI:23763 ! pyrroline is_a: CHEBI:24783 ! imine [Term] id: CHEBI:190958 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phosphorylcholine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:19098 name: 1-pyrrolinecarboxylic acid is_a: CHEBI:23763 ! pyrroline is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:191197 name: branched-chain keto acid is_a: CHEBI:25754 ! oxo carboxylic acid [Term] id: CHEBI:191200 name: medium-chain (3S)-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:191201 name: branched-chain keto acid anion is_a: CHEBI:35903 ! oxo carboxylic acid anion [Term] id: CHEBI:19129 name: 11alpha-hydroxy steroid is_a: CHEBI:36841 ! 11-hydroxy steroid [Term] id: CHEBI:19138 name: 12-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:191398 name: N(tele)-(ADP-D-ribosyl)-L-histidyl(2-) residue subset: chebi_ph7_3 is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:191408 name: ADP-alpha-D-ribose is_a: CHEBI:16960 ! ADP-D-ribose [Term] id: CHEBI:191409 name: ADP-beta-D-ribose is_a: CHEBI:16960 ! ADP-D-ribose [Term] id: CHEBI:19168 name: 17-oxo steroid subset: chebi_ph7_3 is_a: CHEBI:35789 ! oxo steroid is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:191853 name: 8-\{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:35744 ! carbocyclic fatty acid is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:36140 ! cyclopentanones is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:191855 name: 8-[(1S,2S)-3-oxo-2-\{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:191874 name: fatty acid 26:0 is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:19203 name: 1H-pyrrole subset: chebi_ph7_3 is_a: CHEBI:32863 ! secondary amine is_a: CHEBI:35556 ! pyrrole [Term] id: CHEBI:1921 name: 4-oxocyclohexanecarboxylic acid is_a: CHEBI:23482 ! cyclohexanones is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid [Term] id: CHEBI:19217 name: 2',3'-cyclic purine nucleotide is_a: CHEBI:18271 ! 2',3'-cyclic nucleotide is_a: CHEBI:36982 ! cyclic purine nucleotide [Term] id: CHEBI:19218 name: 2',3'-cyclic pyrimidine nucleotide is_a: CHEBI:18271 ! 2',3'-cyclic nucleotide is_a: CHEBI:36983 ! cyclic pyrimidine nucleotide [Term] id: CHEBI:19237 name: 2'-deoxyadenosine 5'-phosphate is_a: CHEBI:19239 ! 2'-deoxyadenosine phosphate [Term] id: CHEBI:192377 name: 2,4-dihydroxypyrimidine-5-carboxylic acid is_a: CHEBI:26447 ! pyrimidinemonocarboxylic acid is_a: CHEBI:38340 ! hydroxypyrimidine [Term] id: CHEBI:19239 name: 2'-deoxyadenosine phosphate is_a: CHEBI:23612 ! deoxyadenosine phosphate [Term] id: CHEBI:192476 name: (2R)-2-methyl-3-oxopropanoic acid is_a: CHEBI:16256 ! 2-methyl-3-oxopropanoic acid [Term] id: CHEBI:192499 name: anthoxanthin is_a: CHEBI:47916 ! flavonoid [Term] id: CHEBI:192500 name: flavanonol is_a: CHEBI:38691 ! flavan [Term] id: CHEBI:192504 name: elicitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:19252 name: 2'-deoxyribonucleoside 3'-monophosphate is_a: CHEBI:19257 ! 2'-deoxyribonucleoside monophosphate is_a: CHEBI:37014 ! 2'-deoxyribonucleoside 3'-phosphate [Term] id: CHEBI:192527 name: ochratoxin alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:38758 ! isocoumarins is_a: CHEBI:38762 ! isochromanes [Term] id: CHEBI:19254 name: purine 2'-deoxyribonucleoside subset: chebi_ph7_3 is_a: CHEBI:18274 ! 2'-deoxyribonucleoside is_a: CHEBI:60173 ! purine deoxyribonucleoside [Term] id: CHEBI:19255 name: pyrimidine 2'-deoxyribonucleoside is_a: CHEBI:18274 ! 2'-deoxyribonucleoside is_a: CHEBI:68472 ! pyrimidine deoxyribonucleoside [Term] id: CHEBI:192560 name: N(tele)-methyl-L-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:19257 name: 2'-deoxyribonucleoside monophosphate is_a: CHEBI:17188 ! nucleoside 5'-monophosphate [Term] id: CHEBI:19260 name: 2'-deoxyribonucleotide is_a: CHEBI:19569 ! 2-deoxyribose phosphate is_a: CHEBI:4431 ! deoxyribonucleotide is_a: CHEBI:47018 ! monohydroxytetrahydrofuran [Term] id: CHEBI:192698 name: L-altritol subset: chebi_ph7_3 is_a: CHEBI:24583 ! hexitol [Term] id: CHEBI:192708 name: a (Kdo)3-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:192714 name: an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue subset: chebi_ph7_3 is_a: CHEBI:132529 ! N(4)-(oligosaccharide-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D-glucosaminyl)-L-asparagine residue [Term] id: CHEBI:19274 name: 2'-deoxymugineic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:192797 name: carcininium subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:19281 name: 2,2'-bithiophenes is_a: CHEBI:26961 ! thiophenes is_a: CHEBI:36820 ! ring assembly [Term] id: CHEBI:192831 name: (E,E)-piperate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:19298 name: 2,3,5-trichloro-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38411 ! chlorocarboxylic acid anion [Term] id: CHEBI:193024 name: an alpha-Kdo-(2->8)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(8-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:193025 name: an alpha-Kdo-(2->4)-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:193059 name: psilocinium subset: chebi_ph7_3 is_a: CHEBI:137982 ! tertiary ammonium ion [Term] id: CHEBI:193068 name: an L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:193069 name: an L-alpha-D-Hep-(1->3)-L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:193073 name: (S)-nephthenol subset: chebi_ph7_3 is_a: CHEBI:60687 ! cembrane diterpenoid [Term] id: CHEBI:193092 name: O-phospho-3-sulfolactate(4-) subset: chebi_ph7_3 is_a: CHEBI:61693 ! carboxyalkyl phosphate oxoanion [Term] id: CHEBI:193107 name: N(6),N(6)-dimethyl-L-lysinium subset: chebi_ph7_3 is_a: CHEBI:62031 ! polar amino acid zwitterion [Term] id: CHEBI:193124 name: N,N-dimethyltryptaminium subset: chebi_ph7_3 is_a: CHEBI:27162 ! tryptamines [Term] id: CHEBI:193125 name: (R)-norlaudanosoline(1+) subset: chebi_ph7_3 is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:193140 name: a 4-O-phospho-alpha-Kdo-(2->6)-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:193141 name: a lipid A(4-) subset: chebi_ph7_3 is_a: CHEBI:58712 ! lipid A(4-) [Term] id: CHEBI:193142 name: an acyl-lipid A(4-) subset: chebi_ph7_3 is_a: CHEBI:58712 ! lipid A(4-) [Term] id: CHEBI:193143 name: a lipid IVB(4-) subset: chebi_ph7_3 is_a: CHEBI:58712 ! lipid A(4-) [Term] id: CHEBI:193144 name: a lipid IIA(2-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:193145 name: a lipid IIB(2-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:193149 name: an acyl-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:193150 name: an alpha-D-Kdo-(2->4)-alpha-D-Kdo-(2->6)-lipid A 1-diphosphate(7-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:193151 name: D-isoleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:19324 name: 2,3-bisphosphoglycerate subset: chebi_ph7_3 is_a: CHEBI:61304 ! phosphoglycerate [Term] id: CHEBI:19327 name: 2-hydroxy-6-(2-hydroxyphenoxy)-6-oxo-cis,cis-hexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:19331 name: (2,4,5-trichlorophenoxy)acetate subset: chebi_ph7_3 is_a: CHEBI:23151 ! chlorophenoxyacetate anion [Term] id: CHEBI:19333 name: 2,4,6-trichloroanisole subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:27096 ! trichlorobenzene [Term] id: CHEBI:19351 name: (2,4-dichlorophenoxy)acetate subset: chebi_ph7_3 is_a: CHEBI:23151 ! chlorophenoxyacetate anion [Term] id: CHEBI:193570 name: 5(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:90822 ! 5-HPETE(1-) [Term] id: CHEBI:193571 name: epi-leukotriene A4(1-) subset: chebi_ph7_3 is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:193574 name: eoxin is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:193594 name: 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:19375 name: 2,5-dichloro-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38425 ! 2,5-dichloromuconate(2-) [Term] id: CHEBI:19391 name: 2,6-dibromophenol is_a: CHEBI:22926 ! bromohydrocarbon is_a: CHEBI:33625 ! dibromophenol relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:194019 name: fumagillin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:194095 name: mitomycin C(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:1941 name: 4-(trimethylammonio)butanoic acid is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:194137 name: neurokinin-1 receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:194140 name: dipalmitoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:19418 name: 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:194240 name: omega-methyl-medium-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion [Term] id: CHEBI:194241 name: omega-hydroxy-medium-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76307 ! omega-hydroxy fatty acid anion [Term] id: CHEBI:194303 name: omega-hydroxy-medium-chain fatty acid is_a: CHEBI:10615 ! omega-hydroxy fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:194304 name: omega-hydroxy-very-long-chain fatty acid is_a: CHEBI:10615 ! omega-hydroxy fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid [Term] id: CHEBI:194306 name: omega-hydroxy-short-chain fatty acid is_a: CHEBI:10615 ! omega-hydroxy fatty acid is_a: CHEBI:26666 ! short-chain fatty acid [Term] id: CHEBI:19432 name: 2-acetamidofluorenes is_a: CHEBI:24059 ! fluorenes [Term] id: CHEBI:194320 name: hydroperoxy monounsaturated fatty acid is_a: CHEBI:194321 ! hydroperoxy unsaturated fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid [Term] id: CHEBI:194321 name: hydroperoxy unsaturated fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid is_a: CHEBI:64009 ! hydroperoxy fatty acid [Term] id: CHEBI:194353 name: (9Z)-11-hydroxy-12,13-epoxyoctadecenoate(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:194386 name: Glycero-3-phosphocholine is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:194431 name: queuosine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:194442 name: alpha-D-mannosyl-4''-O-queuosine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:194443 name: epoxyqueuosine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:194466 name: L-Lysine zwitterion is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:194467 name: NOD1 agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:194473 name: 4-carboxyanilinium is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:194474 name: 4-ammoniobenzoate is_a: CHEBI:76042 ! aromatic amino-acid zwitterion [Term] id: CHEBI:19448 name: 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:38436 ! muconic semialdehyde is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:194491 name: N-acetyl-beta-D-muramoyl-L-alanyl-D-isoglutamine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:194492 name: 6-O-phospho-N-acetylmuramoyl-L-alanyl-D-isoglutamine(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:194499 name: oripavine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:194508 name: (11R)-carlactone subset: chebi_ph7_3 is_a: CHEBI:67190 ! carlactone [Term] id: CHEBI:194518 name: reticuline(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:194519 name: 3,5-dihydroxy-3-methylpentanoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:194520 name: 3,5-dihydroxy-3-methylpentanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:194528 name: an (S)-7,8,13,14-tetrahydroprotoberberine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:194529 name: an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:194548 name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol is_a: CHEBI:33567 ! catecholamine [Term] id: CHEBI:19471 name: 2-aminohexano-6-lactam is_a: CHEBI:22475 ! amino acid amide is_a: CHEBI:23000 ! caprolactams [Term] id: CHEBI:19475 name: 2-aminopentanoic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:1949 name: 4alpha-methylzymosterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:19503 name: propachlor subset: chebi_ph7_3 is_a: CHEBI:13248 ! anilide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:19504 name: 2-chloro-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38411 ! chlorocarboxylic acid anion [Term] id: CHEBI:19511 name: 2-cis,6-cis-farnesyl diphosphate is_a: CHEBI:50277 ! farnesyl diphosphate [Term] id: CHEBI:19515 name: 2-cis,6-trans-farnesyl diphosphate is_a: CHEBI:50277 ! farnesyl diphosphate [Term] id: CHEBI:195219 name: (S)-tetrahydropapaverine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:195237 name: alkenylbenzene is_a: CHEBI:22712 ! benzenes is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:195251 name: activator is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:195252 name: enzyme activator is_a: CHEBI:195251 ! activator is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:195260 name: N-acetyl-D-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58496 ! N-acetyl-D-amino acid anion [Term] id: CHEBI:195274 name: N-acetyl-D-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58496 ! N-acetyl-D-amino acid anion [Term] id: CHEBI:195298 name: loganetin subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38131 ! lactol is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:50563 ! iridoid monoterpenoid is_a: CHEBI:51702 ! enoate ester relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:195358 name: 11-cis-retinyl ester subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester [Term] id: CHEBI:195359 name: 13-cis-retinyl ester subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester [Term] id: CHEBI:195360 name: 9-cis-retinyl ester subset: chebi_ph7_3 is_a: CHEBI:16179 ! retinyl ester [Term] id: CHEBI:195362 name: N-(omega-hydroxyacyl)-sphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:195364 name: (6R)-10-formyltetrahydrofolic acid is_a: CHEBI:15637 ! 10-formyltetrahydrofolic acid [Term] id: CHEBI:195366 name: (6R)-10-formyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:57454 ! 10-formyltetrahydrofolate(2-) [Term] id: CHEBI:195379 name: (S)-tetrahydropapaverine is_a: CHEBI:195380 ! 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline [Term] id: CHEBI:195380 name: 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:46774 ! polyether is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:195403 name: (17S)-HDHA(1-) subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate [Term] id: CHEBI:19543 name: 2-dehydro-L-idonic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:195439 name: 2-aminopropan-1-ol(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:195458 name: butan-1-aminium subset: chebi_ph7_3 is_a: CHEBI:17664 ! alkylaminium [Term] id: CHEBI:195477 name: 2-aminopropan-1-ol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:195478 name: (R)-2-aminopropan-1-ol is_a: CHEBI:195477 ! 2-aminopropan-1-ol [Term] id: CHEBI:195523 name: (R)-mevaldate subset: chebi_ph7_3 is_a: CHEBI:58219 ! mevaldate [Term] id: CHEBI:19555 name: 2-deoxy-D-glucoside is_a: CHEBI:35436 ! D-glucoside [Term] id: CHEBI:195550 name: tetradecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78133 ! fatty alcohol 14:0 [Term] id: CHEBI:195598 name: decanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:197506 ! medium-chain fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol [Term] id: CHEBI:195604 name: nonanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:197506 ! medium-chain fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol [Term] id: CHEBI:195629 name: pentadecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78134 ! fatty alcohol 15:0 [Term] id: CHEBI:19564 name: 2-deoxyribose 1-phosphate is_a: CHEBI:19569 ! 2-deoxyribose phosphate [Term] id: CHEBI:19565 name: 2-deoxyribose 5-phosphate is_a: CHEBI:19569 ! 2-deoxyribose phosphate [Term] id: CHEBI:19568 name: 2-deoxyribose bisphosphate is_a: CHEBI:19569 ! 2-deoxyribose phosphate [Term] id: CHEBI:19569 name: 2-deoxyribose phosphate is_a: CHEBI:23634 ! deoxyaldopentose phosphate [Term] id: CHEBI:19573 name: 2-enoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:1958 name: 5'-dehydroadenosine subset: chebi_ph7_3 is_a: CHEBI:22260 ! adenosines [Term] id: CHEBI:19591 name: 2-hexenal subset: chebi_ph7_3 is_a: CHEBI:13757 ! n-alk-2-enal is_a: CHEBI:24578 ! hexenal [Term] id: CHEBI:19615 name: 2-hydroxy-6-oxonona-2,4-dienedioate subset: chebi_ph7_3 is_a: CHEBI:25575 ! nonadienedioate is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:19641 name: 2-hydroxyisobutyrate subset: chebi_ph7_3 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:19660 name: 2-hydroxyoctadecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:19672 name: 4-oxohex-2-enedioic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:19680 name: 2-methylacetoacetate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:19702 name: N(2)-methylguanosine subset: chebi_ph7_3 is_a: CHEBI:25307 ! methylguanosine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:197289 name: 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid is_a: CHEBI:33823 ! enol is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:52448 ! amino monocarboxylic acid is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:19733 name: (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:197331 name: UDP-D-glucuronic acid is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:197342 name: FAHFA anion is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:197386 name: 1-butanoyl-2-oleoylglycerol is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:197387 name: hexadecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78136 ! fatty alcohol 16:0 [Term] id: CHEBI:197391 name: 1-octanoyl-2-oleoylglycerol is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:197392 name: 1-icosanoyl-2-oleoylglycerol is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:197399 name: heptadecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78137 ! fatty alcohol 17:0 [Term] id: CHEBI:197425 name: a 3-acyl-sn-glycero-1-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:78211 ! 1-acylglycero-3-phospho-1'-glycerol(1-) [Term] id: CHEBI:197457 name: octadecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78138 ! fatty alcohol 18:0 [Term] id: CHEBI:197480 name: icosanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:50584 ! alkyl alcohol is_a: CHEBI:78139 ! fatty alcohol 20:0 [Term] id: CHEBI:197506 name: medium-chain fatty alcohol is_a: CHEBI:24026 ! fatty alcohol [Term] id: CHEBI:197507 name: short-chain fatty alcohol is_a: CHEBI:24026 ! fatty alcohol [Term] id: CHEBI:19763 name: 2-phosphoglycolate is_a: CHEBI:29805 ! glycolate [Term] id: CHEBI:19775 name: quinaldate subset: chebi_ph7_3 is_a: CHEBI:38773 ! quinolinemonocarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:19834 name: 3',5'-cyclic purine nucleotide is_a: CHEBI:18375 ! nucleoside 3',5'-cyclic phosphate is_a: CHEBI:36982 ! cyclic purine nucleotide [Term] id: CHEBI:19835 name: 3',5'-cyclic pyrimidine nucleotide is_a: CHEBI:18375 ! nucleoside 3',5'-cyclic phosphate is_a: CHEBI:36983 ! cyclic pyrimidine nucleotide [Term] id: CHEBI:1989 name: (6R)-5,10-methylenetetrahydrofolic acid is_a: CHEBI:20502 ! 5,10-methylenetetrahydrofolic acid relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:19891 name: 3,4-dihydroxyphenylpyruvic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:19929 name: 3-hydroxy-3-phenylpropionic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:19946 name: xylosylglycoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:19950 name: 3-O-methylgallate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:19960 name: 3-amino-3-(4-hydroxyphenyl)propanoate is_a: CHEBI:49095 ! beta-amino-acid anion [Term] id: CHEBI:19982 name: 3-chloroacrylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36685 ! chlorocarboxylic acid [Term] id: CHEBI:20 name: (+)-camphene subset: chebi_ph7_3 is_a: CHEBI:3830 ! camphene [Term] id: CHEBI:20012 name: 3-enoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:20013 name: 3-epi-3-hydroxymugineic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:20016 name: 3-ethylcatechols is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:2003 name: 5,6-dihydroxyindole-2-carboxylic acid is_a: CHEBI:23781 ! dihydroxyindole relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:20056 name: 3-hydroxy-L-proline is_a: CHEBI:64368 ! 3-hydroxyproline is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:20060 name: 3-hydroxy fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:20067 name: 3-hydroxybutyric acid is_a: CHEBI:24684 ! hydroxybutyric acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:20070 name: 3-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:20081 name: 3-hydroxypropionyl-CoA is_a: CHEBI:26296 ! propanoyl-CoAs [Term] id: CHEBI:20114 name: 3-methylquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:20140 name: 3-methylquinoline subset: chebi_ph7_3 is_a: CHEBI:48982 ! methylquinoline relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:20156 name: 3-oxo-Delta(1) steroid subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:2024 name: 5-acetamidopentanoic acid is_a: CHEBI:22160 ! acetamides relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:20265 name: lanostane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:2030 name: 5-aminoimidazole-4-carboxamide subset: chebi_ph7_3 is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:20346 name: cinnamyl alcohol beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:203600 name: 1D-myo-inositol 1,4,5-trisphosphate(6-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:20361 name: (4-deoxygluc-4-enosyluronic acid)-(1->3)-N-acetyl-D-galactosamine sulfate is_a: CHEBI:37909 ! oligosaccharide sulfate [Term] id: CHEBI:20391 name: 4-hydroxy-L-lysine is_a: CHEBI:24661 ! hydroxy-L-lysine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:86273 ! 4-hydroxylysine [Term] id: CHEBI:20392 name: 4-hydroxyproline is_a: CHEBI:86499 ! monohydroxyproline relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:20432 name: imidazolone is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:20441 name: 4-(methylamino)butyrate is_a: CHEBI:60870 ! aza fatty acid anion [Term] id: CHEBI:20476 name: 4-sulfonatobenzoate(2-) subset: chebi_ph7_3 is_a: CHEBI:36086 ! sulfonatobenzoate [Term] id: CHEBI:20479 name: (5-oxo-2-sulfonato-2,5-dihydrofuran-2-yl)acetate subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:20485 name: 4-pyridones is_a: CHEBI:38183 ! pyridone [Term] id: CHEBI:20502 name: 5,10-methylenetetrahydrofolic acid is_a: CHEBI:22702 ! benzamides is_a: CHEBI:25297 ! methylenetetrahydrofolic acid [Term] id: CHEBI:20506 name: 5,6,7,8-tetrahydrofolic acid is_a: CHEBI:26907 ! tetrahydrofolic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:20515 name: 5,6-dioxidoindole-2-carboxylate is_a: CHEBI:23781 ! dihydroxyindole is_a: CHEBI:38609 ! indolecarboxylate [Term] id: CHEBI:20568 name: 5-deoxyribose phosphate is_a: CHEBI:23634 ! deoxyaldopentose phosphate [Term] id: CHEBI:20569 name: EC 2.5.1.19 (3-phosphoshikimate 1-carboxyvinyltransferase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:20570 name: 5-hydroxycamphor subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:23446 ! cyclic monoterpene ketone [Term] id: CHEBI:20612 name: 5-methyltetrahydrofolate is_a: CHEBI:25345 ! methyltetrahydrofolate [Term] id: CHEBI:20629 name: 5-phosphoribosyl-ATP is_a: CHEBI:20855 ! ATP-sugar [Term] id: CHEBI:20640 name: 5alpha-campestane subset: chebi_ph7_3 is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:35518 ! campestane [Term] id: CHEBI:20642 name: 5alpha-cholane subset: chebi_ph7_3 is_a: CHEBI:35519 ! cholane [Term] id: CHEBI:20652 name: 5alpha-ergostane subset: chebi_ph7_3 is_a: CHEBI:35512 ! ergostane [Term] id: CHEBI:20656 name: 5alpha-pregnane subset: chebi_ph7_3 is_a: CHEBI:61313 ! C21-steroid is_a: CHEBI:8386 ! pregnane [Term] id: CHEBI:20659 name: 5beta-androstane subset: chebi_ph7_3 is_a: CHEBI:35509 ! androstane [Term] id: CHEBI:20664 name: 5beta-cholane subset: chebi_ph7_3 is_a: CHEBI:35519 ! cholane [Term] id: CHEBI:20670 name: 5beta-estrane subset: chebi_ph7_3 is_a: CHEBI:23966 ! estrane [Term] id: CHEBI:20674 name: 5beta-pregnane subset: chebi_ph7_3 is_a: CHEBI:61313 ! C21-steroid is_a: CHEBI:8386 ! pregnane [Term] id: CHEBI:20680 name: 6,7-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:22881 ! biopterins is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:20702 name: 2-aminopurines is_a: CHEBI:22527 ! aminopurine [Term] id: CHEBI:20706 name: 6-aminopurines is_a: CHEBI:22527 ! aminopurine [Term] id: CHEBI:20710 name: 3-dehydro-6-deoxoteasterone subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:22921 ! brassinosteroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36866 ! 23-hydroxy steroid [Term] id: CHEBI:20717 name: 6-deoxotyphasterol subset: chebi_ph7_3 is_a: CHEBI:15889 ! sterol is_a: CHEBI:188922 ! (22S)-22-hydroxy C28-steroid is_a: CHEBI:22921 ! brassinosteroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36866 ! 23-hydroxy steroid [Term] id: CHEBI:20750 name: 6-phospho-2-dehydro-D-gluconate(3-) subset: chebi_ph7_3 is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:2076 name: 5-hydroxykynurenine is_a: CHEBI:86497 ! hydroxykynurenine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:20794 name: 7-methylguanosine subset: chebi_ph7_3 is_a: CHEBI:25307 ! methylguanosine is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:20805 name: (+)-8'-hydroxyabscisic acid is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid [Term] id: CHEBI:20814 name: phenanthrene-9,10-diol subset: chebi_ph7_3 is_a: CHEBI:37453 ! phenanthrenediol [Term] id: CHEBI:2082 name: 5-hydroxyxanthotoxin is_a: CHEBI:26369 ! psoralens relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:20847 name: ADP-glycero-D-manno-heptose is_a: CHEBI:17193 ! ADP-aldose [Term] id: CHEBI:20853 name: AMP-sugar is_a: CHEBI:64711 ! purine nucleotide-sugar [Term] id: CHEBI:20855 name: ATP-sugar is_a: CHEBI:64711 ! purine nucleotide-sugar [Term] id: CHEBI:20857 name: C-glycosyl compound is_a: CHEBI:63161 ! glycosyl compound is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:20858 name: C19-gibberellin is_a: CHEBI:24250 ! gibberellin [Term] id: CHEBI:20859 name: C20-gibberellin is_a: CHEBI:24250 ! gibberellin [Term] id: CHEBI:20873 name: CDP-sugar is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar [Term] id: CHEBI:20878 name: CMP-sugar is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar [Term] id: CHEBI:20891 name: (R)-4'-phosphopantothenate(2-) is_a: CHEBI:37481 ! amidoalkyl phosphate [Term] id: CHEBI:20899 name: D-alloisoleucine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:22359 ! alloisoleucine [Term] id: CHEBI:20902 name: allose phosphate is_a: CHEBI:21037 ! aldohexose phosphate [Term] id: CHEBI:20912 name: D-arabinonic acid is_a: CHEBI:33509 ! arabinonic acid [Term] id: CHEBI:20937 name: D-fructuronic acid is_a: CHEBI:24113 ! fructuronic acid [Term] id: CHEBI:20954 name: D-galactosaminide is_a: CHEBI:24587 ! hexosaminide [Term] id: CHEBI:20960 name: galactose phosphate is_a: CHEBI:21037 ! aldohexose phosphate [Term] id: CHEBI:20961 name: D-galactoside is_a: CHEBI:24163 ! galactoside [Term] id: CHEBI:20971 name: D-galactosyl-N-acetyl-D-glucosaminyl-(1->3)-D-galactosyl-(1->4)-D-glucosylceramide is_a: CHEBI:36507 ! D-galactosyl-N-acetyl-D-glucosaminyl-D-galactosyl-D-glucosylceramide [Term] id: CHEBI:21005 name: D-glucose bisphosphate is_a: CHEBI:21008 ! glucose phosphate [Term] id: CHEBI:21006 name: D-glucose monophosphate is_a: CHEBI:21008 ! glucose phosphate [Term] id: CHEBI:21008 name: glucose phosphate is_a: CHEBI:21037 ! aldohexose phosphate [Term] id: CHEBI:21010 name: D-glucosyl-D-mannose is_a: CHEBI:35318 ! glycosylmannose [Term] id: CHEBI:21037 name: aldohexose phosphate is_a: CHEBI:35131 ! aldose phosphate is_a: CHEBI:47878 ! hexose phosphate [Term] id: CHEBI:21040 name: D-idarate(2-) subset: chebi_ph7_3 is_a: CHEBI:35385 ! idarate(2-) [Term] id: CHEBI:21041 name: D-idaric acid is_a: CHEBI:24765 ! idaric acid [Term] id: CHEBI:21054 name: mannonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:2106 name: 5-[(E)-caffeoyl]shikimic acid is_a: CHEBI:23483 ! cyclohexenecarboxylic acid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33566 ! catechols is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:21060 name: mannose phosphate is_a: CHEBI:21037 ! aldohexose phosphate [Term] id: CHEBI:21077 name: D-ribonic acid is_a: CHEBI:33511 ! ribonic acid relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:21080 name: ribose diphosphate is_a: CHEBI:26562 ! ribose phosphate [Term] id: CHEBI:21099 name: D-tagaturonic acid is_a: CHEBI:26845 ! tagaturonic acid [Term] id: CHEBI:211 name: (3S)-3-isopropenyl-6-oxoheptanoate subset: chebi_ph7_3 is_a: CHEBI:64234 ! 3-isopropenyl-6-oxoheptanoate [Term] id: CHEBI:21100 name: D-altrarate(1-) is_a: CHEBI:35389 ! altrarate(1-) [Term] id: CHEBI:21101 name: D-altraric acid is_a: CHEBI:26847 ! altraric acid [Term] id: CHEBI:21161 name: GDP-D-mannuronic acid is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:21165 name: GDP-alpha-D-mannosylchitobiosyldiphosphodolichol is_a: CHEBI:23102 ! chitobiosyldiphosphodolichol is_a: CHEBI:35244 ! nucleotide-oligosaccharide [Term] id: CHEBI:21167 name: GDP-hexose is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:21168 name: GDP-mannose is_a: CHEBI:21167 ! GDP-hexose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:21169 name: GDP-sugar is_a: CHEBI:64711 ! purine nucleotide-sugar [Term] id: CHEBI:21203 name: L-2-aminohexanoate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:21217 name: L-alaninamide is_a: CHEBI:22475 ! amino acid amide is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:21239 name: arogenic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:21260 name: cysteic acid is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:23509 ! cysteine derivative is_a: CHEBI:37793 ! amino sulfonic acid is_a: CHEBI:38031 ! carboxyalkanesulfonic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:21282 name: (3S,5S)-3,5-diaminohexanoate is_a: CHEBI:59561 ! diamino acid anion [Term] id: CHEBI:21285 name: erythro-4-hydroxy-L-glutamic acid is_a: CHEBI:32811 ! 4-hydroxy-L-glutamic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:21288 name: L-erythrose subset: chebi_ph7_3 is_a: CHEBI:33946 ! erythrose [Term] id: CHEBI:21291 name: L-fuconate subset: chebi_ph7_3 is_a: CHEBI:24115 ! fuconate [Term] id: CHEBI:21314 name: glutamyl phosphate is_a: CHEBI:36951 ! aminoacyl phosphate [Term] id: CHEBI:21332 name: L-idarate(2-) subset: chebi_ph7_3 is_a: CHEBI:35385 ! idarate(2-) [Term] id: CHEBI:21333 name: L-idaric acid is_a: CHEBI:24765 ! idaric acid [Term] id: CHEBI:21336 name: L-idonic acid is_a: CHEBI:21337 ! idonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:21337 name: idonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:21363 name: L-methionine sulfone is_a: CHEBI:132188 ! methionine sulfone is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:21368 name: L-ornithine derivative is_a: CHEBI:25718 ! ornithine derivative [Term] id: CHEBI:21374 name: L-prolinamide is_a: CHEBI:22475 ! amino acid amide is_a: CHEBI:46770 ! pyrrolidinecarboxamide is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:21376 name: rhamnonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:21397 name: L-altrarate(1-) is_a: CHEBI:35389 ! altrarate(1-) relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:21398 name: L-altraric acid is_a: CHEBI:26847 ! altraric acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:21415 name: L-tyrosyl ester is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:33853 ! phenols is_a: CHEBI:46874 ! alpha-amino acid ester [Term] id: CHEBI:21437 name: Mo-molybdopterin cofactor is_a: CHEBI:25372 ! molybdopterin cofactor is_a: CHEBI:35202 ! molybdenum coordination entity relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:21494 name: N-acetoxyarylamine subset: chebi_ph7_3 is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:21498 name: N-acetyl-7-O-acetylneuraminic acid is_a: CHEBI:21569 ! N-acetyl-O-acetylneuraminic acid [Term] id: CHEBI:2150 name: 5beta-dihydrotestosterone subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:85278 ! 17beta-hydroxyandrostan-3-one relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:21500 name: N-acetyl-9-O-acetylneuraminic acid is_a: CHEBI:21569 ! N-acetyl-O-acetylneuraminic acid [Term] id: CHEBI:21501 name: N-acetyl-D-amino acid is_a: CHEBI:15778 ! N-acyl-D-amino acid is_a: CHEBI:21575 ! N-acetyl-amino acid [Term] id: CHEBI:21507 name: N-acetyl-D-galactosaminyl group is_a: CHEBI:24160 ! galactosaminyl group [Term] id: CHEBI:21509 name: N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine is_a: CHEBI:51013 ! beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer [Term] id: CHEBI:21519 name: N-acetyl-D-glucosamine 1-phosphate is_a: CHEBI:21635 ! N-acyl-D-glucosamine 1-phosphate [Term] id: CHEBI:21524 name: N-acetyl-D-glucosaminyl groups is_a: CHEBI:24272 ! glucosaminyl group [Term] id: CHEBI:21545 name: N-acetyl-L-amino acid is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:21644 ! N-acyl-L-amino acid is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:21547 name: N-acetyl-L-aspartic acid is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:21647 ! N-acyl-L-aspartic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:21549 name: N-acetyl-L-glutamate(1-) is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:21557 name: N-acetyl-L-methionine is_a: CHEBI:132958 ! N-acetylmethionine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:84121 ! L-methionine derivative relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:21565 name: N-acetyl-L-valine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:84129 ! L-valine derivative [Term] id: CHEBI:21569 name: N-acetyl-O-acetylneuraminic acid is_a: CHEBI:21652 ! N-acyl-O-acetylneuraminic acid [Term] id: CHEBI:21575 name: N-acetyl-amino acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:22195 ! acetyl-amino acid is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:21601 name: N-acetyl-D-hexosamine subset: chebi_ph7_3 is_a: CHEBI:7203 ! N-acetylhexosamine [Term] id: CHEBI:21615 name: N-acetyl-D-muramic acid is_a: CHEBI:47965 ! N-acetylmuramic acid [Term] id: CHEBI:21619 name: N-acetylneuraminates is_a: CHEBI:21663 ! N-acylneuraminates [Term] id: CHEBI:21622 name: N-acetylneuraminic acids is_a: CHEBI:16498 ! N-acylneuraminic acid is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:21626 name: N-acetylphenylalanine is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:25985 ! phenylalanine derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35469 ! antidepressant [Term] id: CHEBI:21635 name: N-acyl-D-glucosamine 1-phosphate is_a: CHEBI:21637 ! N-acyl-D-glucosamine phosphate [Term] id: CHEBI:21637 name: N-acyl-D-glucosamine phosphate is_a: CHEBI:24269 ! glucosamine phosphate [Term] id: CHEBI:21638 name: N-acylglucosamine is_a: CHEBI:21656 ! N-acyl-hexosamine is_a: CHEBI:24271 ! glucosamines [Term] id: CHEBI:2164 name: 6-acetamido-3-aminohexanoic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:33706 ! beta-amino acid [Term] id: CHEBI:21644 name: N-acyl-L-amino acid is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:21645 name: N-acyl-L-arginine is_a: CHEBI:21644 ! N-acyl-L-amino acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:21647 name: N-acyl-L-aspartic acid is_a: CHEBI:21654 ! N-acyl-aspartic acid is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:83978 ! L-aspartic acid derivative [Term] id: CHEBI:2165 name: 6-acetamido-3-oxohexanoic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:21650 name: N-acyl-L-glutamic acid is_a: CHEBI:21658 ! N-acylglutamic acid is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:21652 name: N-acyl-O-acetylneuraminic acid is_a: CHEBI:26667 ! sialic acid [Term] id: CHEBI:21654 name: N-acyl-aspartic acid is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:21655 name: N-acylgalactosamine is_a: CHEBI:21656 ! N-acyl-hexosamine is_a: CHEBI:24156 ! galactosamine [Term] id: CHEBI:21656 name: N-acyl-hexosamine is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:21658 name: N-acylglutamic acid is_a: CHEBI:24315 ! glutamic acid derivative [Term] id: CHEBI:21662 name: N-acylneuraminic acid phosphate is_a: CHEBI:22529 ! amino sugar phosphate [Term] id: CHEBI:21663 name: N-acylneuraminates is_a: CHEBI:25506 ! neuraminates [Term] id: CHEBI:21668 name: N-alanyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:21672 name: N-amidino-amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:21675 name: N-asparaginyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:21676 name: N-aspartyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:21681 name: N-benzoyl-D-arginines is_a: CHEBI:22702 ! benzamides is_a: CHEBI:83966 ! D-arginine derivative [Term] id: CHEBI:21686 name: N-carbamoyl-L-amino acid is_a: CHEBI:21689 ! N-carbamoyl-amino acid [Term] id: CHEBI:21689 name: N-carbamoyl-amino acid is_a: CHEBI:47857 ! ureas is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:21698 name: N-cysteinyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:21731 name: N-glycosyl compound is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:63161 ! glycosyl compound is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:21732 name: N-glycyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:21745 name: N-(long-chain-fatty-acyl)-L-glutamic acid is_a: CHEBI:137550 ! N-(fatty acyl)-L-alpha-amino acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid [Term] id: CHEBI:21752 name: N-methyl-L-alpha-amino acid is_a: CHEBI:21760 ! N-methyl-amino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:21760 name: N-methyl-amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:21763 name: N-methylethanolamine is_a: CHEBI:23981 ! ethanolamines [Term] id: CHEBI:21766 name: N-methylglycines is_a: CHEBI:66933 ! N-alkylglycine [Term] id: CHEBI:21776 name: N-myristoyl amino acid is_a: CHEBI:25455 ! myristoyl amino acid [Term] id: CHEBI:21787 name: N-seryl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:2179 name: D-fucopyranose subset: chebi_ph7_3 is_a: CHEBI:28847 ! D-fucose is_a: CHEBI:48206 ! fucopyranose [Term] id: CHEBI:21794 name: N-sulfoglucosamine is_a: CHEBI:21638 ! N-acylglucosamine is_a: CHEBI:35719 ! sulfamic acids [Term] id: CHEBI:21805 name: N(2')-acetylgentamycin is_a: CHEBI:22200 ! acetylgentamycin [Term] id: CHEBI:21806 name: N(2),N(5)-diacyl-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative [Term] id: CHEBI:2181 name: L-fucopyranose subset: chebi_ph7_3 is_a: CHEBI:18287 ! L-fucose is_a: CHEBI:48206 ! fucopyranose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:21815 name: N2-acyl-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative [Term] id: CHEBI:21816 name: N(2)-glutamino group is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:21826 name: N(3')-acetylgentamycin is_a: CHEBI:22200 ! acetylgentamycin [Term] id: CHEBI:21836 name: N(4)-glycosyl-L-asparagine is_a: CHEBI:35269 ! N-glycosyl amino acid is_a: CHEBI:52987 ! L-asparagine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:21844 name: N(5)-alkyl-L-glutamine is_a: CHEBI:24317 ! L-glutamine derivative [Term] id: CHEBI:21858 name: hypusine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:21860 name: L-pyrrolysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine is_a: CHEBI:83813 ! proteinogenic amino acid is_a: CHEBI:91273 ! pyrrolysine [Term] id: CHEBI:21865 name: N(6)-dimethylallyladenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:21894 name: N6-myristoyl-L-lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine is_a: CHEBI:21776 ! N-myristoyl amino acid [Term] id: CHEBI:21911 name: N(alpha)-methyl-L-histidines is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid [Term] id: CHEBI:21949 name: O-butanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:7676 ! O-butanoylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:21957 name: O-glycosyl-L-serine is_a: CHEBI:35272 ! O-glycosyl amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:21958 name: O-glycosyl-L-threonine is_a: CHEBI:35272 ! O-glycosyl amino acid is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:21968 name: O-phosphoamino acid is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:26051 ! phosphoamino acid is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:21969 name: O-phosphorylhomoserine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:24619 ! homoserine derivative [Term] id: CHEBI:21976 name: o-succinylhomoserine is_a: CHEBI:24619 ! homoserine derivative [Term] id: CHEBI:21977 name: O-(N-acetylglucosamine-1-phosphoryl)-L-serine is_a: CHEBI:21635 ! N-acyl-D-glucosamine 1-phosphate is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:21990 name: O(4')-glycosyl-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:35272 ! O-glycosyl amino acid [Term] id: CHEBI:21993 name: O(4)-glycosyl-L-hydroxyproline is_a: CHEBI:35272 ! O-glycosyl amino acid [Term] id: CHEBI:22020 name: S-(ADP-ribosyl)-L-cysteine is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:22043 name: S-farnesyl-L-cysteine is_a: CHEBI:13796 ! S-polyprenyl-L-cysteine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:22046 name: S-geranylgeranyl-L-cysteine is_a: CHEBI:13796 ! S-polyprenyl-L-cysteine [Term] id: CHEBI:22063 name: sulfoxide is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:22064 name: S-palmitoyl amino acid is_a: CHEBI:25838 ! palmitoyl amino acid [Term] id: CHEBI:22065 name: S-palmitoyl-L-cysteine is_a: CHEBI:134526 ! S-(long-chain fatty acyl)-L-cysteine is_a: CHEBI:22064 ! S-palmitoyl amino acid is_a: CHEBI:25840 ! palmitoyl-L-cysteine [Term] id: CHEBI:2208 name: purine-6-thiol subset: chebi_ph7_3 is_a: CHEBI:82711 ! aryl thiol relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:22080 name: TDP-sugar is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar [Term] id: CHEBI:22099 name: UDP-D-galactosamine is_a: CHEBI:16846 ! UDP-alpha-D-galactosamine [Term] id: CHEBI:22102 name: UDP-D-glucosamine is_a: CHEBI:13497 ! UDP-alpha-D-glucosamine [Term] id: CHEBI:22119 name: UDP-N-acetylmannosaminouronic acid is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:221278 name: (R)-nipecotic acid is_a: CHEBI:116931 ! nipecotic acid [Term] id: CHEBI:22144 name: abscisic aldehyde subset: chebi_ph7_3 is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:22151 name: (+)-abscisic acid beta-D-glucopyranosyl ester subset: chebi_ph7_3 is_a: CHEBI:62436 ! (+)-abscisic acid D-glucopyranosyl ester [Term] id: CHEBI:22152 name: 2-cis-abscisic acid is_a: CHEBI:62431 ! abscisic acids relationship: has_role CHEBI:73191 ! abscisic acid receptor agonist [Term] id: CHEBI:22153 name: acaricide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:22154 name: acenaphthene subset: chebi_ph7_3 is_a: CHEBI:22156 ! acenaphthenes [Term] id: CHEBI:22156 name: acenaphthenes is_a: CHEBI:38033 ! acenaphthylenes [Term] id: CHEBI:22160 name: acetamides is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:22177 name: acetohydroxamic acids is_a: CHEBI:24650 ! hydroxamic acid [Term] id: CHEBI:22179 name: acetohydroximates is_a: CHEBI:22177 ! acetohydroxamic acids [Term] id: CHEBI:22180 name: EC 2.2.1.6 (acetolactate synthase) inhibitor is_a: CHEBI:76876 ! EC 2.2.1.* (transketolase/transaldolase) inhibitor [Term] id: CHEBI:22187 name: acetophenones is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:22191 name: acetyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59918 ! acyl monophosphate(2-) relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:22193 name: acetyl-L-lysine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:25095 ! L-lysine derivative [Term] id: CHEBI:22194 name: acetyl-L-serine is_a: CHEBI:22195 ! acetyl-amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:22195 name: acetyl-amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22198 name: acetylcysteine is_a: CHEBI:22195 ! acetyl-amino acid is_a: CHEBI:23509 ! cysteine derivative [Term] id: CHEBI:2220 name: 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:22200 name: acetylgentamycin is_a: CHEBI:17833 ! gentamycin [Term] id: CHEBI:22201 name: acetylkanamycin is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:22204 name: acetylspermidine is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:22205 name: acetylspermine is_a: CHEBI:26735 ! substituted spermine [Term] id: CHEBI:22210 name: aconitate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:22211 name: aconitic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:22213 name: acridines is_a: CHEBI:39206 ! dibenzopyridine [Term] id: CHEBI:22216 name: acrylamides is_a: CHEBI:51751 ! enamide [Term] id: CHEBI:222169 name: (S)-nipecotic acid is_a: CHEBI:116931 ! nipecotic acid [Term] id: CHEBI:22221 name: acyl group is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:22229 name: acylglutathione is_a: CHEBI:24337 ! glutathione derivative [Term] id: CHEBI:22231 name: acylglycerone phosphate is_a: CHEBI:24356 ! glycerone phosphates relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:22235 name: adamantanones is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51339 ! adamantanes [Term] id: CHEBI:22251 name: adenosine bisphosphate is_a: CHEBI:22256 ! adenosine phosphate is_a: CHEBI:61078 ! purine nucleoside bisphosphate is_a: CHEBI:61079 ! ribonucleoside bisphosphate [Term] id: CHEBI:22256 name: adenosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate is_a: CHEBI:61296 ! adenyl ribonucleotide [Term] id: CHEBI:22260 name: adenosines is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:22266 name: adipate semialdehyde is_a: CHEBI:26643 ! aldehydic acid [Term] id: CHEBI:22271 name: aflatoxin is_a: CHEBI:48210 ! cyclopentafurofurochromene relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:22278 name: alanine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22289 name: aldaric acid anion is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:2229 name: 6-phospho-2-dehydro-D-gluconic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:22290 name: aldaric acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:22292 name: alditol 1-phosphate is_a: CHEBI:22297 ! alditol phosphate [Term] id: CHEBI:22294 name: alditol 4-phosphate is_a: CHEBI:22297 ! alditol phosphate [Term] id: CHEBI:22295 name: alditol 5-phosphate is_a: CHEBI:22297 ! alditol phosphate [Term] id: CHEBI:22297 name: alditol phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:63423 ! alditol derivative [Term] id: CHEBI:22299 name: aldonate is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:22300 name: aldonic acid phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:22301 name: aldonic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33720 ! carbohydrate acid [Term] id: CHEBI:22302 name: aldonolactone is_a: CHEBI:37421 ! carbohydrate lactone [Term] id: CHEBI:22307 name: aldoxime subset: chebi_ph7_3 is_a: CHEBI:25750 ! oxime [Term] id: CHEBI:22313 name: alkaline earth metal atom is_a: CHEBI:33318 ! main group element atom is_a: CHEBI:33521 ! metal atom is_a: CHEBI:33559 ! s-block element atom [Term] id: CHEBI:22314 name: alkali metal atom is_a: CHEBI:33318 ! main group element atom is_a: CHEBI:33521 ! metal atom is_a: CHEBI:33559 ! s-block element atom [Term] id: CHEBI:22315 name: alkaloid is_a: CHEBI:35352 ! organonitrogen compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:22319 name: alkanesulfinate is_a: CHEBI:37785 ! organosulfinate oxoanion relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:22323 name: alkyl group is_a: CHEBI:33248 ! hydrocarbyl group [Term] id: CHEBI:22324 name: alkyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:22326 name: S-alkylsulfenic acid subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:51334 ! SO-thioperoxol [Term] id: CHEBI:22327 name: aliphatic sulfide is_a: CHEBI:16385 ! organic sulfide [Term] id: CHEBI:22329 name: alkyl-sn-glycerol 3-phosphate is_a: CHEBI:26706 ! sn-glycerol 3-phosphates [Term] id: CHEBI:22331 name: alkylamines is_a: CHEBI:32952 ! amine [Term] id: CHEBI:22332 name: alkylamino group is_a: CHEBI:33456 ! organoheteryl group [Term] id: CHEBI:22333 name: alkylating agent is_a: CHEBI:25435 ! mutagen [Term] id: CHEBI:22335 name: alkylglycerone phosphate is_a: CHEBI:24356 ! glycerone phosphates is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:22339 name: alkyne is_a: CHEBI:33650 ! acyclic acetylene [Term] id: CHEBI:22340 name: all-cis-7,10,13-hexadecatrienoic acid is_a: CHEBI:24545 ! hexadecatrienoic acid is_a: CHEBI:25681 ! omega-3 fatty acid [Term] id: CHEBI:22359 name: alloisoleucine is_a: CHEBI:38264 ! 2-amino-3-methylpentanoic acid [Term] id: CHEBI:22385 name: alpha-D-glucan is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:22390 name: alpha-D-glucoside is_a: CHEBI:35436 ! D-glucoside is_a: CHEBI:60979 ! alpha-glucoside [Term] id: CHEBI:224037 name: 3-sulfinato-L-alaninate(2-) is_a: CHEBI:22319 ! alkanesulfinate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:22423 name: alpha-L-fucosyl-(1->2)-D-galactose subset: chebi_ph7_3 is_a: CHEBI:35317 ! glycosylgalactose [Term] id: CHEBI:224366 name: tert-butylammonium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:22440 name: alpha-N-substituted L-arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:22445 name: alpha-aspartyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:22450 name: (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one is_a: CHEBI:12336 ! alpha-cyclopiazonic acids [Term] id: CHEBI:22453 name: alpha-glutamyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:22455 name: alpha-hydroxynitrile is_a: CHEBI:24730 ! hydroxynitrile [Term] id: CHEBI:22469 name: alpha-terpineol subset: chebi_ph7_3 is_a: CHEBI:26876 ! terpineol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:2247 name: 7,8-diaminononanoic acid is_a: CHEBI:52448 ! amino monocarboxylic acid is_a: CHEBI:59650 ! amino fatty acid [Term] id: CHEBI:22470 name: alpha-tocopherol is_a: CHEBI:27013 ! tocopherol is_a: CHEBI:33234 ! vitamin E relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77962 ! food antioxidant [Term] id: CHEBI:22475 name: amino acid amide is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22478 name: amino alcohol is_a: CHEBI:30879 ! alcohol is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:22479 name: amino cyclitol glycoside is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:22480 name: amino disaccharide is_a: CHEBI:22483 ! amino oligosaccharide is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:22483 name: amino oligosaccharide is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:22484 name: galactosamine oligosaccharide is_a: CHEBI:22483 ! amino oligosaccharide [Term] id: CHEBI:22485 name: glucosamine oligosaccharide is_a: CHEBI:22483 ! amino oligosaccharide [Term] id: CHEBI:22487 name: alpha-aminoacyl group is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:22490 name: aminoadipate semialdehyde is_a: CHEBI:22266 ! adipate semialdehyde [Term] id: CHEBI:22492 name: amino aldehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:22493 name: aminobenzenesulfonate is_a: CHEBI:22713 ! arenesulfonate oxoanion is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:22494 name: aminobenzoate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:22495 name: aminobenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33856 ! aromatic amino acid [Term] id: CHEBI:22496 name: aminobiphenyl is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:50471 ! primary arylamine [Term] id: CHEBI:22497 name: aminobutanal is_a: CHEBI:22939 ! butanals [Term] id: CHEBI:22500 name: aminobutanoyl-CoA is_a: CHEBI:22954 ! butanoyl-CoAs [Term] id: CHEBI:22501 name: aminodiol is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:23824 ! diol [Term] id: CHEBI:22506 name: aminoglycan is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:22507 name: aminoglycoside antibiotic is_a: CHEBI:23007 ! carbohydrate-containing antibiotic is_a: CHEBI:47779 ! aminoglycoside [Term] id: CHEBI:2251 name: 7,8-dihydromethanopterin is_a: CHEBI:37669 ! methanopterins [Term] id: CHEBI:22512 name: aminoimidazole is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:225237 name: 2-phenylethanaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:225238 name: benzylaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:22527 name: aminopurine is_a: CHEBI:26401 ! purines [Term] id: CHEBI:22529 name: amino sugar phosphate is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:33447 ! phospho sugar [Term] id: CHEBI:22532 name: aminouracil is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:22542 name: androstane-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:2255 name: 7beta-aminocephalosporanic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:22557 name: anhydrohexose is_a: CHEBI:22558 ! anhydro sugar [Term] id: CHEBI:22558 name: anhydro sugar is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:22562 name: anilines is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33860 ! aromatic amine [Term] id: CHEBI:22563 name: anion is_a: CHEBI:24870 ! ion [Term] id: CHEBI:22565 name: ansamycin is_a: CHEBI:24995 ! lactam is_a: CHEBI:26188 ! polyketide is_a: CHEBI:51026 ! macrocycle [Term] id: CHEBI:22569 name: anthocyanidin glucoside is_a: CHEBI:71583 ! anthocyanidin glycoside [Term] id: CHEBI:22580 name: anthraquinone is_a: CHEBI:46955 ! anthracenes is_a: CHEBI:51285 ! acenoquinone [Term] id: CHEBI:22583 name: antifeedant is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:22586 name: antioxidant is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:22587 name: antiviral agent is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:22590 name: arabinan is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:22593 name: arabinitol phosphate is_a: CHEBI:25898 ! pentitol phosphate [Term] id: CHEBI:22595 name: arabinonate is_a: CHEBI:33764 ! arabinonates [Term] id: CHEBI:22598 name: arabinonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:22599 name: arabinose is_a: CHEBI:33916 ! aldopentose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:2260 name: 7-deoxyloganic acid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:50563 ! iridoid monoterpenoid is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:72293 ! monoterpene glycoside is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:22600 name: arabinose phosphate is_a: CHEBI:25900 ! aldopentose phosphate [Term] id: CHEBI:22601 name: arabinoside is_a: CHEBI:35312 ! pentoside [Term] id: CHEBI:22603 name: arabinoxylans is_a: CHEBI:37166 ! xylan [Term] id: CHEBI:22605 name: arabinitol is_a: CHEBI:25899 ! pentitol relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:22617 name: arginine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22629 name: arsenate ion is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:22632 name: arsenic molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_part CHEBI:27563 ! arsenic atom [Term] id: CHEBI:22633 name: arsenite ion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:22638 name: organoarsonic acid is_a: CHEBI:33406 ! organoarsenic compound [Term] id: CHEBI:22644 name: arylalkylamine is_a: CHEBI:22331 ! alkylamines [Term] id: CHEBI:22645 name: arenecarboxamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:62733 ! aromatic amide [Term] id: CHEBI:22648 name: arylmercury compound is_a: CHEBI:25706 ! organomercury compound [Term] id: CHEBI:22651 name: ascorbate is_a: CHEBI:24961 ! ketoaldonate relationship: has_role CHEBI:22586 ! antioxidant [Term] id: CHEBI:22652 name: ascorbic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:22653 name: asparagine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide relationship: has_part CHEBI:50330 ! 2-amino-2-oxoethyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:22654 name: asparagine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22656 name: asparaginyl group subset: chebi_ph7_3 is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:22658 name: aspartate family amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid [Term] id: CHEBI:22660 name: aspartic acid is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_part CHEBI:41402 ! carboxymethyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:22661 name: aspartic acid derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22669 name: aspulvinone is_a: CHEBI:50523 ! butenolide relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:22676 name: auxin is_a: CHEBI:37848 ! plant hormone [Term] id: CHEBI:22682 name: azobenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:37533 ! azo compound [Term] id: CHEBI:22691 name: barbiturate anion is_a: CHEBI:22693 ! barbiturates [Term] id: CHEBI:22693 name: barbiturates is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:50268 ! GABA modulator [Term] id: CHEBI:22695 name: base is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:22698 name: benzaldehydes is_a: CHEBI:33855 ! arenecarbaldehyde [Term] id: CHEBI:227 name: (-)-cis-carveol subset: chebi_ph7_3 is_a: CHEBI:23046 ! carveol [Term] id: CHEBI:22702 name: benzamides is_a: CHEBI:22645 ! arenecarboxamide [Term] id: CHEBI:22706 name: benzenetetrol is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33573 ! tetrol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:22707 name: benzenetriol is_a: CHEBI:27136 ! triol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:22712 name: benzenes is_a: CHEBI:33836 ! benzenoid aromatic compound [Term] id: CHEBI:22713 name: arenesulfonate oxoanion is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:22715 name: benzimidazoles is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:22718 name: benzoates is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:91007 ! aromatic carboxylate [Term] id: CHEBI:22720 name: benzodiazepine is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound relationship: has_role CHEBI:50268 ! GABA modulator [Term] id: CHEBI:22723 name: benzoic acids is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:22726 name: benzophenones is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:22727 name: benzopyran is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:22728 name: benzopyrrole is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38180 ! polycyclic heteroarene [Term] id: CHEBI:22729 name: benzoquinones is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:22730 name: benzosemiquinones is_a: CHEBI:15817 ! semiquinone [Term] id: CHEBI:22731 name: 3-oxo-3-phenylpropionate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:22736 name: benzoyl-CoAs is_a: CHEBI:61940 ! aroyl-CoA [Term] id: CHEBI:22743 name: benzyl alcohols is_a: CHEBI:33854 ! aromatic alcohol [Term] id: CHEBI:22744 name: benzyl group subset: chebi_ph7_3 is_a: CHEBI:33452 ! benzylic group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:22746 name: 2-benzylsuccinyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:22748 name: benzyl 2-methyl-3-hydroxybutanoate subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:90628 ! benzyl ester [Term] id: CHEBI:22750 name: benzylisoquinoline alkaloid is_a: CHEBI:24921 ! isoquinoline alkaloid [Term] id: CHEBI:22754 name: berberine alkaloid is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:38512 ! dibenzoquinolizine [Term] id: CHEBI:22778 name: beta-D-galactosyl groups is_a: CHEBI:24164 ! galactosyl group [Term] id: CHEBI:22788 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide relationship: has_part CHEBI:12357 ! beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl group [Term] id: CHEBI:22798 name: beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:35436 ! D-glucoside is_a: CHEBI:60980 ! beta-glucoside [Term] id: CHEBI:228 name: (4R,7R)-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:50238 ! 4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:22801 name: beta-D-glucosyl-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:18368 ! D-glucosyl-N-acylsphingosine is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:22823 name: beta-alanine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:22838 name: beta-cyclopiazonic acid is_a: CHEBI:38615 ! cyclopiazonic acid [Term] id: CHEBI:22860 name: amino-acid betaine is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:22866 name: bilanes is_a: CHEBI:25046 ! linear tetrapyrrole [Term] id: CHEBI:22869 name: bilins is_a: CHEBI:25046 ! linear tetrapyrrole [Term] id: CHEBI:22872 name: (glucosyluronic acid)bilirubin is_a: CHEBI:33886 ! glucuronic acids [Term] id: CHEBI:2288 name: 7alpha,12alpha-dihydroxy-5beta-cholestan-3-one subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:22881 name: biopterins is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:22888 name: biphenyls is_a: CHEBI:33836 ! benzenoid aromatic compound is_a: CHEBI:36820 ! ring assembly is_a: CHEBI:64459 ! biaryl [Term] id: CHEBI:22894 name: bis(molybdopterin guanine dinucleotide)molybdenum is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:37146 ! molybdopterin dinucleotide [Term] id: CHEBI:22899 name: bisdechlorogeodin subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:37613 ! cyclohexadiene is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:38830 ! 1-benzofurans relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:2290 name: 7alpha-hydroxy-5beta-cholestan-3-one subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:22901 name: bisphenol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:22902 name: bisphosphoglyceric acid is_a: CHEBI:24346 ! phosphoglyceric acid [Term] id: CHEBI:22905 name: blasticidin is_a: CHEBI:26440 ! pyrimidine nucleoside relationship: has_role CHEBI:25605 ! nucleoside antibiotic [Term] id: CHEBI:22907 name: bleomycin is_a: CHEBI:23089 ! chelate-forming peptide is_a: CHEBI:24396 ! glycopeptide relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:22908 name: borate is_a: CHEBI:22909 ! borate ion [Term] id: CHEBI:22909 name: borate ion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:33619 ! boron oxoanion [Term] id: CHEBI:22912 name: bornane monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:22916 name: boron molecular entity is_a: CHEBI:33581 ! boron group molecular entity relationship: has_part CHEBI:27560 ! boron atom [Term] id: CHEBI:22917 name: phytogenic insecticide is_a: CHEBI:24852 ! insecticide [Term] id: CHEBI:22918 name: branched-chain amino acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:22921 name: brassinosteroid is_a: CHEBI:26124 ! phytosteroid [Term] id: CHEBI:22926 name: bromohydrocarbon is_a: CHEBI:24472 ! halohydrocarbon is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:22927 name: bromine atom subset: chebi_ph7_3 is_a: CHEBI:24473 ! halogen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:22928 name: bromine molecular entity is_a: CHEBI:24471 ! halogen molecular entity relationship: has_part CHEBI:22927 ! bromine atom [Term] id: CHEBI:22929 name: bromoalkane is_a: CHEBI:24469 ! haloalkane is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:22930 name: bromoamino acid is_a: CHEBI:24470 ! haloamino acid is_a: CHEBI:37158 ! bromocarboxylic acid [Term] id: CHEBI:22939 name: butanals is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:22944 name: butanediols is_a: CHEBI:23824 ! diol [Term] id: CHEBI:22950 name: butan-4-olide is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:47016 ! tetrahydrofuranone [Term] id: CHEBI:22951 name: butanone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:22954 name: butanoyl-CoAs is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:22958 name: butenedioic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:22959 name: butenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:22961 name: butenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15469 ! alk-2-enoyl-CoA [Term] id: CHEBI:22965 name: butanamides is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:22967 name: butyn-1-ols is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:22968 name: butynal is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:22970 name: butynediol is_a: CHEBI:23824 ! diol is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:22975 name: cadinane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:22976 name: cadinene is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:22984 name: calcium atom subset: chebi_ph7_3 is_a: CHEBI:22313 ! alkaline earth metal atom relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:22985 name: calcium molecular entity is_a: CHEBI:33299 ! alkaline earth molecular entity relationship: has_part CHEBI:22984 ! calcium atom [Term] id: CHEBI:22986 name: calcium ionophore is_a: CHEBI:24869 ! ionophore [Term] id: CHEBI:22990 name: camalexin subset: chebi_ph7_3 is_a: CHEBI:24797 ! indole phytoalexin is_a: CHEBI:38418 ! 1,3-thiazoles relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:22998 name: canadine subset: chebi_ph7_3 is_a: CHEBI:22754 ! berberine alkaloid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:23000 name: caprolactams is_a: CHEBI:24995 ! lactam [Term] id: CHEBI:23003 name: carbamate ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:23004 name: carbamoyl group subset: chebi_ph7_3 is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:23007 name: carbohydrate-containing antibiotic is_a: CHEBI:63299 ! carbohydrate derivative relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:23012 name: carbon disulfide subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:23014 name: carbon oxide is_a: CHEBI:25701 ! organic oxide is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:23016 name: carbonates is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:23018 name: EC 4.2.1.1 (carbonic anhydrase) inhibitor is_a: CHEBI:76907 ! EC 4.2.1.* (hydro-lyases) inhibitor [Term] id: CHEBI:23019 name: carbonyl group subset: chebi_ph7_3 is_a: CHEBI:51422 ! organodiyl group [Term] id: CHEBI:23022 name: carboxy-2-hydroxymuconate semialdehyde is_a: CHEBI:25422 ! muconate semialdehyde [Term] id: CHEBI:23041 name: carotenal is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:27325 ! xanthophyll [Term] id: CHEBI:23042 name: carotene is_a: CHEBI:35193 ! tetraterpene [Term] id: CHEBI:23043 name: epoxycarotenoid is_a: CHEBI:27325 ! xanthophyll is_a: CHEBI:32955 ! epoxide [Term] id: CHEBI:23044 name: carotenoid is_a: CHEBI:26935 ! tetraterpenoid [Term] id: CHEBI:23045 name: carotenol is_a: CHEBI:27325 ! xanthophyll [Term] id: CHEBI:23046 name: carveol subset: chebi_ph7_3 is_a: CHEBI:25040 ! limonene monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:23048 name: carvones is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:23053 name: catechin subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:23064 name: cephalosporanic acid is_a: CHEBI:23066 ! cephalosporin [Term] id: CHEBI:23066 name: cephalosporin is_a: CHEBI:38311 ! cephem relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:23073 name: glycopentaosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:23075 name: glycotetraosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:23079 name: cerebroside is_a: CHEBI:17761 ! ceramide is_a: CHEBI:25513 ! neutral glycosphingolipid [Term] id: CHEBI:23084 name: cetraxates is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:50754 ! cyclohexanecarboxylate ester relationship: has_role CHEBI:23888 ! drug [Term] id: CHEBI:23086 name: chalcones is_a: CHEBI:51689 ! enone is_a: CHEBI:72544 ! flavonoids is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:23089 name: chelate-forming peptide is_a: CHEBI:25903 ! peptide antibiotic relationship: has_role CHEBI:38161 ! chelator [Term] id: CHEBI:23098 name: chiro-inositol is_a: CHEBI:24848 ! inositol [Term] id: CHEBI:23101 name: N,N'-diacetylchitobioses is_a: CHEBI:22480 ! amino disaccharide [Term] id: CHEBI:23102 name: chitobiosyldiphosphodolichol is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide is_a: CHEBI:23875 ! dolichol phosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:231086 name: Octadec-9-enoic acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:2311 name: Oplophorus luciferin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:37847 ! imidazopyrazine relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:23114 name: chloride salt is_a: CHEBI:23117 ! chlorine molecular entity is_a: CHEBI:33958 ! halide salt relationship: has_part CHEBI:17996 ! chloride [Term] id: CHEBI:23115 name: chlorohydrocarbon is_a: CHEBI:24472 ! halohydrocarbon is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23116 name: chlorine atom subset: chebi_ph7_3 is_a: CHEBI:24473 ! halogen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:23117 name: chlorine molecular entity is_a: CHEBI:24471 ! halogen molecular entity relationship: has_part CHEBI:23116 ! chlorine atom [Term] id: CHEBI:23123 name: chloroacetate subset: chebi_ph7_3 is_a: CHEBI:85638 ! haloacetate(1-) [Term] id: CHEBI:23127 name: chloroalanine is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:23129 ! chloroamino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:23128 name: chloroalkane is_a: CHEBI:24469 ! haloalkane is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23129 name: chloroamino acid is_a: CHEBI:24470 ! haloamino acid is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23130 name: chloroaniline is_a: CHEBI:23132 ! chlorobenzenes is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:23132 name: chlorobenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23133 name: chlorobenzoate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:23134 name: chlorobenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:36685 ! chlorocarboxylic acid [Term] id: CHEBI:23135 name: chlorobenzophenone is_a: CHEBI:22726 ! benzophenones is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:23136 name: chlorobenzoyl-CoA is_a: CHEBI:22736 ! benzoyl-CoAs is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62048 ! haloacyl-CoA [Term] id: CHEBI:23138 name: chlorocatechol is_a: CHEBI:23132 ! chlorobenzenes is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:23139 name: chlorocyclohexene is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:23140 name: chlorodienelactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23141 name: chloroethanol is_a: CHEBI:23982 ! ethanols is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:23142 name: chloroethenes is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:36387 ! chloroalkene is_a: CHEBI:51316 ! haloethene [Term] id: CHEBI:23147 name: chlorohydroquinones is_a: CHEBI:23132 ! chlorobenzenes is_a: CHEBI:24646 ! hydroquinones [Term] id: CHEBI:23148 name: chloromethanes is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:23128 ! chloroalkane is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:23150 name: chlorophenol is_a: CHEBI:23132 ! chlorobenzenes is_a: CHEBI:38856 ! halophenol [Term] id: CHEBI:23151 name: chlorophenoxyacetate anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:23152 name: chlorophenoxyacetic acid is_a: CHEBI:23132 ! chlorobenzenes is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:23154 name: chlorophenylethane is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:23155 name: chlorophenylethylene is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:23156 name: chlorophenylmethane is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:23162 name: chloropropene is_a: CHEBI:36387 ! chloroalkene [Term] id: CHEBI:23178 name: cholest-7-ene subset: chebi_ph7_3 is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:231935 name: glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:23197 name: cholestanoyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:232 name: (+)-cis-carveol subset: chebi_ph7_3 is_a: CHEBI:23046 ! carveol [Term] id: CHEBI:23203 name: cholestenoyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:23213 name: choline ester is_a: CHEBI:35701 ! ester [Term] id: CHEBI:23216 name: choline sulfates is_a: CHEBI:23213 ! choline ester is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester [Term] id: CHEBI:23217 name: cholines is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:23218 name: choloyl-CoAs is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:23219 name: bile acid taurine conjugate is_a: CHEBI:36249 ! bile acid conjugate [Term] id: CHEBI:23229 name: chromanol is_a: CHEBI:23230 ! chromanes is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:23230 name: chromanes is_a: CHEBI:38443 ! 1-benzopyran [Term] id: CHEBI:23232 name: chromenes is_a: CHEBI:38443 ! 1-benzopyran [Term] id: CHEBI:23237 name: chromium molecular entity is_a: CHEBI:33741 ! chromium group molecular entity relationship: has_part CHEBI:28073 ! chromium atom [Term] id: CHEBI:23238 name: chromones is_a: CHEBI:38445 ! chromenone [Term] id: CHEBI:23239 name: chromopeptide is_a: CHEBI:25903 ! peptide antibiotic [Term] id: CHEBI:23240 name: chromophore is_a: CHEBI:52215 ! photochemical role [Term] id: CHEBI:23243 name: cineole is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:37407 ! cyclic ether relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:23245 name: cinnamaldehydes is_a: CHEBI:51688 ! enal [Term] id: CHEBI:23247 name: cinnamamides is_a: CHEBI:51751 ! enamide [Term] id: CHEBI:23248 name: cinnamate subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:36091 ! cinnamates [Term] id: CHEBI:23252 name: cinnamic acids is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:23286 name: cis-3,4-dihydrophenanthrene-3,4-diol is_a: CHEBI:37464 ! 3,4-dihydrophenanthrene-3,4-diol [Term] id: CHEBI:233 name: (4S,7R)-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:50238 ! 4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:23324 name: citrullines is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:23333 name: cob(III)alamins is_a: CHEBI:23334 ! cobalamins [Term] id: CHEBI:23334 name: cobalamins is_a: CHEBI:176843 ! vitamin B12 is_a: CHEBI:23341 ! cobamides [Term] id: CHEBI:23336 name: cobalt cation is_a: CHEBI:33515 ! transition element cation [Term] id: CHEBI:23341 name: cobamides is_a: CHEBI:23390 ! cobalt-corrinoid hexaamide [Term] id: CHEBI:23345 name: cobyric acid is_a: CHEBI:23390 ! cobalt-corrinoid hexaamide [Term] id: CHEBI:23347 name: coclaurine is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:24923 ! isoquinolinol is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:23354 name: coenzyme is_a: CHEBI:23357 ! cofactor [Term] id: CHEBI:23356 name: S-substituted coenzyme M is_a: CHEBI:33551 ! organosulfonic acid [Term] id: CHEBI:23357 name: cofactor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:23360 name: colitose subset: chebi_ph7_3 is_a: CHEBI:23703 ! dideoxyhexose [Term] id: CHEBI:23366 name: compatible osmolytes is_a: CHEBI:25728 ! osmolyte [Term] id: CHEBI:23367 name: molecular entity is_a: CHEBI:24431 ! chemical entity [Term] id: CHEBI:23375 name: copalyl diphosphate is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36772 ! diterpenyl phosphate is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:23377 name: copper molecular entity is_a: CHEBI:33745 ! copper group molecular entity relationship: has_part CHEBI:28694 ! copper atom [Term] id: CHEBI:23378 name: copper cation subset: chebi_ph7_3 is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:37404 ! elemental copper relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:23388 name: coproporphyrin is_a: CHEBI:26214 ! porphyrins [Term] id: CHEBI:23389 name: cobalt-corrinoid heptacarboxylic acid is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:23390 name: cobalt-corrinoid hexaamide is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:23392 name: corrins is_a: CHEBI:33913 ! corrinoid [Term] id: CHEBI:23396 name: cortisol ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:23399 name: coumarate is_a: CHEBI:36091 ! cinnamates [Term] id: CHEBI:23401 name: coumaric acid is_a: CHEBI:24688 ! monohydroxycinnamic acid [Term] id: CHEBI:23403 name: coumarins is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:38445 ! chromenone [Term] id: CHEBI:23410 name: cumate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:23412 name: cumic acid is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:23417 name: cutins is_a: CHEBI:26178 ! polyester macromolecule is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33694 ! biomacromolecule [Term] id: CHEBI:23423 name: pseudohalogen oxoacid is_a: CHEBI:24833 ! oxoacid [Term] id: CHEBI:23424 name: cyanides is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:23436 name: cyanogenic glycoside is_a: CHEBI:18379 ! nitrile is_a: CHEBI:24400 ! glycoside relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:23437 name: cyanohydrin subset: chebi_ph7_3 is_a: CHEBI:22455 ! alpha-hydroxynitrile [Term] id: CHEBI:23443 name: cyclic amide is_a: CHEBI:32988 ! amide [Term] id: CHEBI:23445 name: cyclic hydroxamic acid is_a: CHEBI:24650 ! hydroxamic acid is_a: CHEBI:24995 ! lactam [Term] id: CHEBI:23446 name: cyclic monoterpene ketone is_a: CHEBI:25408 ! monoterpene ketone is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:23447 name: cyclic nucleotide is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:23448 name: cyclic oligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:23449 name: cyclic peptide is_a: CHEBI:16670 ! peptide [Term] id: CHEBI:23450 name: cyclitol phosphate is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:23451 name: cyclitol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:23453 name: cycloalkane is_a: CHEBI:33654 ! alicyclic compound is_a: CHEBI:33664 ! monocyclic hydrocarbon [Term] id: CHEBI:23456 name: cyclodextrin is_a: CHEBI:17623 ! cyclomaltodextrin is_a: CHEBI:51026 ! macrocycle [Term] id: CHEBI:23457 name: cyclodiene organochlorine insecticide is_a: CHEBI:25705 ! organochlorine insecticide [Term] id: CHEBI:23466 name: cyclohexadienecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:23468 name: cyclohexadienecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:23469 name: cyclohexadienediol is_a: CHEBI:23824 ! diol is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:23470 name: cyclohexadienol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:23478 name: cyclohexanedione is_a: CHEBI:23482 ! cyclohexanones [Term] id: CHEBI:23480 name: cyclohexanols is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:23482 name: cyclohexanones is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:23483 name: cyclohexenecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:23493 name: cyclopentanes is_a: CHEBI:33598 ! carbocyclic compound [Term] id: CHEBI:23495 name: cyclopentanols is_a: CHEBI:23493 ! cyclopentanes is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:23500 name: cyclopropanecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:51454 ! cyclopropanes [Term] id: CHEBI:23503 name: 4-amino-1,2-oxazolidin-3-one is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:38329 ! oxazolidines is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:75606 ! hydroxamic acid ester [Term] id: CHEBI:23505 name: cystathionines is_a: CHEBI:24610 ! homocysteines [Term] id: CHEBI:23509 name: cysteine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:23511 name: cysteinyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:23518 name: cytidine 3'-phosphate is_a: CHEBI:23523 ! cytidine phosphate [Term] id: CHEBI:23521 name: cytidine 5'-phosphate is_a: CHEBI:23523 ! cytidine phosphate [Term] id: CHEBI:23523 name: cytidine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:23524 name: cytidines is_a: CHEBI:39446 ! pyrimidine ribonucleosides [Term] id: CHEBI:23527 name: cytochalasin B subset: chebi_ph7_3 is_a: CHEBI:23528 ! cytochalasin is_a: CHEBI:24995 ! lactam is_a: CHEBI:25000 ! lactone is_a: CHEBI:26979 ! organic heterotricyclic compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:70728 ! actin polymerisation inhibitor [Term] id: CHEBI:23528 name: cytochalasin is_a: CHEBI:24897 ! isoindoles [Term] id: CHEBI:23530 name: cytokinin is_a: CHEBI:37848 ! plant hormone [Term] id: CHEBI:23557 name: dTDP-sugar is_a: CHEBI:22080 ! TDP-sugar [Term] id: CHEBI:23582 name: defoliant is_a: CHEBI:24527 ! herbicide [Term] id: CHEBI:23591 name: dehydroamino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:23612 name: deoxyadenosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate is_a: CHEBI:61297 ! adenyl deoxyribonucleotide [Term] id: CHEBI:23614 name: deoxycholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:23618 name: deoxycortisol is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:23621 name: deoxycytidine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:23622 name: deoxygalactose is_a: CHEBI:23628 ! deoxyhexose [Term] id: CHEBI:23623 name: deoxyglucose is_a: CHEBI:23628 ! deoxyhexose [Term] id: CHEBI:23625 name: deoxyguanosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:23627 name: deoxyaldohexose phosphate is_a: CHEBI:21037 ! aldohexose phosphate is_a: CHEBI:63352 ! deoxyaldohexose derivative [Term] id: CHEBI:23628 name: deoxyhexose is_a: CHEBI:23639 ! deoxy sugar is_a: CHEBI:33917 ! aldohexose [Term] id: CHEBI:23630 name: deoxyinosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:23634 name: deoxyaldopentose phosphate is_a: CHEBI:25900 ! aldopentose phosphate [Term] id: CHEBI:23635 name: deoxypentose is_a: CHEBI:23639 ! deoxy sugar [Term] id: CHEBI:23636 name: deoxyribonucleoside is_a: CHEBI:33838 ! nucleoside [Term] id: CHEBI:23638 name: deoxyribulose phosphate is_a: CHEBI:26573 ! ribulose phosphate is_a: CHEBI:35161 ! deoxyketopentose phosphate [Term] id: CHEBI:23639 name: deoxy sugar is_a: CHEBI:16646 ! carbohydrate [Term] id: CHEBI:23641 name: deoxyuridine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:23643 name: depsipeptide is_a: CHEBI:16670 ! peptide [Term] id: CHEBI:2365 name: (+)-abscisic acid is_a: CHEBI:22152 ! 2-cis-abscisic acid relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:23666 name: diamine is_a: CHEBI:88061 ! polyamine [Term] id: CHEBI:23671 name: 2,6-diaminopimelate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:23673 name: 2,6-diaminopimelic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36164 ! amino dicarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:23677 name: diazole is_a: CHEBI:68452 ! azole [Term] id: CHEBI:23681 name: dibenzothiophene subset: chebi_ph7_3 is_a: CHEBI:23684 ! dibenzothiophenes is_a: CHEBI:36416 ! mancude organic heterotricyclic parent relationship: has_role CHEBI:50176 ! keratolytic drug [Term] id: CHEBI:23683 name: dibenzothiophene 5-oxide subset: chebi_ph7_3 is_a: CHEBI:23684 ! dibenzothiophenes relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:23684 name: dibenzothiophenes is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:23690 name: dicarboxylic acid amide is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:23696 name: dichloroaniline is_a: CHEBI:23130 ! chloroaniline is_a: CHEBI:23697 ! dichlorobenzene [Term] id: CHEBI:23697 name: dichlorobenzene is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:23698 name: dichlorobenzoyl-CoA is_a: CHEBI:23136 ! chlorobenzoyl-CoA is_a: CHEBI:23697 ! dichlorobenzene [Term] id: CHEBI:23699 name: dichlorocatechol is_a: CHEBI:23138 ! chlorocatechol is_a: CHEBI:23697 ! dichlorobenzene [Term] id: CHEBI:23700 name: dichlorohydroquinone is_a: CHEBI:23147 ! chlorohydroquinones is_a: CHEBI:23697 ! dichlorobenzene [Term] id: CHEBI:23702 name: dichlorophenol is_a: CHEBI:23150 ! chlorophenol is_a: CHEBI:23697 ! dichlorobenzene [Term] id: CHEBI:23703 name: dideoxyhexose is_a: CHEBI:23628 ! deoxyhexose [Term] id: CHEBI:23711 name: diethyl 2-methyl-3-hydroxysuccinate is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:51307 ! diester [Term] id: CHEBI:23730 name: 5-oxo-2-furylacetic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:23733 name: dihydrocarvone subset: chebi_ph7_3 is_a: CHEBI:61672 ! dihydrocarvones relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:23736 name: 4,5-dihydrocortisone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:23738 name: dihydrophenanthrenediol is_a: CHEBI:25961 ! phenanthrenes [Term] id: CHEBI:23741 name: dihydrodipicolinic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:50075 ! dihydropyridine [Term] id: CHEBI:23743 name: dihydrofolic acids is_a: CHEBI:37445 ! folic acids [Term] id: CHEBI:23750 name: S-substituted dihydrolipoamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:2376 name: acarbose is_a: CHEBI:63567 ! tetrasaccharide derivative relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:50627 ! EC 3.2.1.1 (alpha-amylase) inhibitor relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor [Term] id: CHEBI:23763 name: pyrroline is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:23765 name: quinolone is_a: CHEBI:26513 ! quinolines [Term] id: CHEBI:23775 name: dihydroxy-5beta-cholanic acid is_a: CHEBI:24663 ! hydroxy-5beta-cholanic acid is_a: CHEBI:85184 ! dihydroxycholanic acid [Term] id: CHEBI:23776 name: dihydroxyacetophenone is_a: CHEBI:24668 ! hydroxyacetophenone [Term] id: CHEBI:23778 name: dihydroxybenzoic acid is_a: CHEBI:24676 ! hydroxybenzoic acid [Term] id: CHEBI:23781 name: dihydroxyindole is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:23783 name: naphthalenediols is_a: CHEBI:24727 ! hydroxynaphthalene [Term] id: CHEBI:23792 name: dihydroxypteridine is_a: CHEBI:26373 ! pteridines is_a: CHEBI:74818 ! heteroaryl hydroxy compound [Term] id: CHEBI:23793 name: dihydroxypyridine is_a: CHEBI:24745 ! hydroxypyridine [Term] id: CHEBI:237958 name: (\{[(2R,3S,4R,5R)-3,4-dihydroxy-5-(9H-purin-9-yl)oxolan-2-yl]methyl phosphonato}oxy)(phosphonatooxy)phosphinate is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:23796 name: diiodotyrosine is_a: CHEBI:24865 ! iodotyrosine is_a: CHEBI:53680 ! dihalogenated L-tyrosine [Term] id: CHEBI:23798 name: dimethoxyflavone is_a: CHEBI:25241 ! methoxyflavone [Term] id: CHEBI:23806 name: dimethylaniline is_a: CHEBI:25275 ! methylaniline [Term] id: CHEBI:23809 name: dimethylbenzimidazole is_a: CHEBI:22715 ! benzimidazoles [Term] id: CHEBI:23812 name: dimethylmaleic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:23816 name: dimethylsilanediol subset: chebi_ph7_3 is_a: CHEBI:26673 ! organosilanediol [Term] id: CHEBI:23818 name: dimethylxanthine is_a: CHEBI:25348 ! methylxanthine [Term] id: CHEBI:23822 name: dinitrotoluene is_a: CHEBI:25566 ! nitrotoluene [Term] id: CHEBI:23824 name: diol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:23825 name: dibenzodioxine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:27171 ! organic heterobicyclic compound relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:23843 name: disaccharide phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:23847 name: diterpene alkaloid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26871 ! terpene alkaloid [Term] id: CHEBI:23849 name: diterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:23853 name: dithiol is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:23858 name: behenate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion is_a: CHEBI:78127 ! fatty acid anion 22:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:23866 name: dodecanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:197506 ! medium-chain fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol [Term] id: CHEBI:23867 name: dodecenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:23869 name: dodecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:23872 name: dodecyl sulfate subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:23875 name: dolichol phosphate is_a: CHEBI:16030 ! acyldolichol is_a: CHEBI:37841 ! isoprenoid phosphate [Term] id: CHEBI:23888 name: drug is_a: CHEBI:52217 ! pharmaceutical [Term] id: CHEBI:23893 name: ecdysone phosphate is_a: CHEBI:23895 ! ecdysteroid ester is_a: CHEBI:36944 ! steroid phosphate [Term] id: CHEBI:23895 name: ecdysteroid ester is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:23897 name: ecdysteroid is_a: CHEBI:35341 ! steroid relationship: has_role CHEBI:24621 ! hormone [Term] id: CHEBI:23899 name: icosanoid is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:23902 name: icosenoic acid is_a: CHEBI:132538 ! fatty acid 20:1 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:23905 name: monoatomic anion is_a: CHEBI:22563 ! anion is_a: CHEBI:24867 ! monoatomic ion [Term] id: CHEBI:23906 name: monoatomic cation is_a: CHEBI:24867 ! monoatomic ion is_a: CHEBI:36916 ! cation [Term] id: CHEBI:23924 name: enzyme inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:23925 name: (+)-5-epi-aristolochene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:23929 name: episterol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:50403 ! ergostanoid is_a: CHEBI:50586 ! 9xi-episterol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:23931 name: epoxy monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:32955 ! epoxide [Term] id: CHEBI:2394 name: acetochlor subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:23943 name: ergot alkaloid is_a: CHEBI:65322 ! hemiterpenoid indole alkaloid [Term] id: CHEBI:23948 name: erythro-3-methylmalic acid is_a: CHEBI:25312 ! 3-methylmalic acid [Term] id: CHEBI:23953 name: erythromycins is_a: CHEBI:25105 ! macrolide antibiotic [Term] id: CHEBI:23955 name: erythronolide is_a: CHEBI:25106 ! macrolide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:23956 name: erythrose phosphate is_a: CHEBI:35138 ! aldotetrose phosphate [Term] id: CHEBI:23957 name: erythroses is_a: CHEBI:33915 ! aldotetrose [Term] id: CHEBI:23958 name: erythrulose subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:24981 ! ketotetrose [Term] id: CHEBI:23965 name: estradiol subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36838 ! 17-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:23966 name: estrane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:23976 name: ethanediol is_a: CHEBI:23824 ! diol [Term] id: CHEBI:23981 name: ethanolamines is_a: CHEBI:22478 ! amino alcohol [Term] id: CHEBI:23982 name: ethanols is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:23990 name: ethyl ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:23997 name: ethyl 3-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:78206 ! fatty acid ethyl ester [Term] id: CHEBI:24002 name: ethylene releasers is_a: CHEBI:26155 ! plant growth regulator [Term] id: CHEBI:24012 name: farnesal subset: chebi_ph7_3 is_a: CHEBI:36757 ! farnesane sesquiterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:24018 name: farnesyl phosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:24020 name: fat-soluble vitamin (role) is_a: CHEBI:33229 ! vitamin (role) [Term] id: CHEBI:24026 name: fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:24027 name: fatty-acyl group is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:24028 name: iron(3+) chelator is_a: CHEBI:38157 ! iron chelator [Term] id: CHEBI:24031 name: ferulic acids is_a: CHEBI:24688 ! monohydroxycinnamic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:24040 name: flavin adenine dinucleotide is_a: CHEBI:30527 ! flavin is_a: CHEBI:36981 ! flavin nucleotide is_a: CHEBI:47885 ! dinucleotide relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:24041 name: flavin mononucleotide is_a: CHEBI:30527 ! flavin is_a: CHEBI:36981 ! flavin nucleotide is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:24043 name: flavones subset: chebi_ph7_3 is_a: CHEBI:192499 ! anthoxanthin is_a: CHEBI:47916 ! flavonoid [Term] id: CHEBI:24057 name: fluoren-9-ones is_a: CHEBI:24059 ! fluorenes is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:24059 name: fluorenes is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:24061 name: fluorine atom subset: chebi_ph7_3 is_a: CHEBI:24473 ! halogen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:24062 name: fluorine molecular entity is_a: CHEBI:24471 ! halogen molecular entity relationship: has_part CHEBI:24061 ! fluorine atom [Term] id: CHEBI:24067 name: fluoroalkane is_a: CHEBI:24469 ! haloalkane is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:24068 name: fluoroamino acid is_a: CHEBI:24470 ! haloamino acid is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:24079 name: formamides is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:24085 name: formimidoyltetrahydrofolic acid is_a: CHEBI:26907 ! tetrahydrofolic acid [Term] id: CHEBI:24090 name: formyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59918 ! acyl monophosphate(2-) [Term] id: CHEBI:24099 name: formyltetrahydrofolic acid is_a: CHEBI:26907 ! tetrahydrofolic acid [Term] id: CHEBI:24103 name: fructosamine is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:24108 name: fructosylglycine is_a: CHEBI:24103 ! fructosamine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:35258 ! glyco-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24109 name: fructosyllysine is_a: CHEBI:24103 ! fructosamine is_a: CHEBI:35258 ! glyco-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:24112 name: fructuronate is_a: CHEBI:33901 ! fructuronates [Term] id: CHEBI:24113 name: fructuronic acid is_a: CHEBI:33883 ! fructuronic acids [Term] id: CHEBI:24115 name: fuconate is_a: CHEBI:33769 ! fuconates [Term] id: CHEBI:24116 name: fuconic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:24119 name: fucoside is_a: CHEBI:35315 ! deoxy hexoside [Term] id: CHEBI:24121 name: fucosyl oligoglycosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide is_a: CHEBI:36638 ! fucosyl glycosphingolipid [Term] id: CHEBI:24127 name: fungicide is_a: CHEBI:25944 ! pesticide is_a: CHEBI:35718 ! antifungal agent [Term] id: CHEBI:24128 name: furanocoumarin is_a: CHEBI:39432 ! furochromene [Term] id: CHEBI:24129 name: furans is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:24138 name: galactaric acid derivative is_a: CHEBI:63438 ! hexaric acid derivative [Term] id: CHEBI:24144 name: galactoglucomannan is_a: CHEBI:61298 ! D-glucose- and/or D-galactose-substituted mannan [Term] id: CHEBI:24145 name: galactoglycerolipid is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63425 ! galactosylglycerol derivative [Term] id: CHEBI:24148 name: galactonate is_a: CHEBI:33778 ! galactonates [Term] id: CHEBI:24149 name: galactonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24150 name: galactonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:24151 name: galactooligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:24154 name: galactosamine phosphate is_a: CHEBI:24584 ! hexosamine phosphate [Term] id: CHEBI:24155 name: galactosamine sulfate is_a: CHEBI:24585 ! hexosamine sulfate [Term] id: CHEBI:24156 name: galactosamine is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:24158 name: galactosaminoglycan is_a: CHEBI:18085 ! glycosaminoglycan [Term] id: CHEBI:24160 name: galactosaminyl group is_a: CHEBI:24399 ! glycosaminyl group [Term] id: CHEBI:24163 name: galactoside is_a: CHEBI:35313 ! hexoside [Term] id: CHEBI:24164 name: galactosyl group is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:24167 name: galactosylglycerol phosphate is_a: CHEBI:36310 ! glycosylglycerol phosphate [Term] id: CHEBI:24168 name: galactosylglycerol is_a: CHEBI:24406 ! glycosylglycerol is_a: CHEBI:36307 ! glycosyl alditol [Term] id: CHEBI:24174 name: galacturonan is_a: CHEBI:18154 ! polysaccharide [Term] id: CHEBI:24175 name: galacturonate is_a: CHEBI:33812 ! galacturonates [Term] id: CHEBI:24183 name: galloyl beta-D-glucose is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:24190 name: gamma-glutamyl group is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:24195 name: gamma-glutamylcysteine is_a: CHEBI:24323 ! glutamyl-L-amino acid is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:24215 name: gentiobioside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:24221 name: 3,7-dimethylocta-2,6-dien-1-ol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:25639 ! octadienol is_a: CHEBI:26199 ! polyprenol [Term] id: CHEBI:24229 name: geranylgeraniol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26199 ! polyprenol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:70868 ! antileishmanial agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:24232 name: geranylgeranylglycerol 1-phosphate is_a: CHEBI:26707 ! glycerol phosphate is_a: CHEBI:36571 ! prenylglycerol phosphate [Term] id: CHEBI:24233 name: geranylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:2424 name: acetylpyruvic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:67265 ! beta-diketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:24250 name: gibberellin is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:33575 ! carboxylic acid relationship: has_role CHEBI:37848 ! plant hormone [Term] id: CHEBI:24261 name: glucocorticoid is_a: CHEBI:36699 ! corticosteroid hormone [Term] id: CHEBI:24262 name: glucoglycerolipid is_a: CHEBI:24385 ! glycoglycerolipid [Term] id: CHEBI:24265 name: gluconate is_a: CHEBI:33804 ! gluconates [Term] id: CHEBI:24266 name: gluconic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:24267 name: gluconolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:24268 name: glucooligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:24269 name: glucosamine phosphate is_a: CHEBI:24584 ! hexosamine phosphate [Term] id: CHEBI:24271 name: glucosamines is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:24272 name: glucosaminyl group is_a: CHEBI:24399 ! glycosaminyl group [Term] id: CHEBI:24273 name: glucosaminylamine is_a: CHEBI:24271 ! glucosamines [Term] id: CHEBI:24274 name: glucosaminylphosphodolichol is_a: CHEBI:23875 ! dolichol phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:24275 name: glucosaminylphosphatidylinositol is_a: CHEBI:24410 ! glycosylphosphatidylinositol [Term] id: CHEBI:24278 name: glucoside is_a: CHEBI:35313 ! hexoside [Term] id: CHEBI:24279 name: glucosinolate subset: chebi_ph7_3 is_a: CHEBI:24401 ! glycosinolate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:24280 name: D-glucosyl group subset: chebi_ph7_3 is_a: CHEBI:24281 ! glucosyl group [Term] id: CHEBI:24281 name: glucosyl group is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:24282 name: glucosyl hydroxycinnamic acid is_a: CHEBI:24688 ! monohydroxycinnamic acid [Term] id: CHEBI:24286 name: glucosylglycerol phosphate is_a: CHEBI:36310 ! glycosylglycerol phosphate is_a: CHEBI:63426 ! glucosylglycerol derivative [Term] id: CHEBI:24287 name: glucosylglycerol is_a: CHEBI:24406 ! glycosylglycerol is_a: CHEBI:36307 ! glycosyl alditol [Term] id: CHEBI:24289 name: glucosyl-N(6)-isopentenyladenine is_a: CHEBI:38643 ! 6-isopentenylaminopurine relationship: has_role CHEBI:23530 ! cytokinin [Term] id: CHEBI:24297 name: glucuronate is_a: CHEBI:33903 ! glucuronates [Term] id: CHEBI:24298 name: glucuronic acid is_a: CHEBI:33886 ! glucuronic acids relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24301 name: glucuronolactone is_a: CHEBI:37431 ! uronolactone relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:24302 name: glucosiduronic acid is_a: CHEBI:35314 ! glycosiduronic acid is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:24309 name: glutaconic acid is_a: CHEBI:36129 ! pentenedioic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24311 name: glutaconyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:24313 name: glutamic semialdehyde is_a: CHEBI:26643 ! aldehydic acid [Term] id: CHEBI:24315 name: glutamic acid derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:24317 name: L-glutamine derivative is_a: CHEBI:70813 ! glutamine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:24318 name: glutamine family amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid [Term] id: CHEBI:24319 name: EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor is_a: CHEBI:76823 ! EC 6.3.1.* (acid-ammonia/amine ligase) inhibitor [Term] id: CHEBI:24321 name: glutamo group is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:24323 name: glutamyl-L-amino acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:24326 name: glutaramic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:24329 name: glutarate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:24333 name: glutaryl-CoAs is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:24335 name: glutathione conjugate is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:24337 name: glutathione derivative is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:24344 name: 2-phosphoglyceric acid is_a: CHEBI:25405 ! monophosphoglyceric acid is_a: CHEBI:63455 ! tetronic acid derivative [Term] id: CHEBI:24346 name: phosphoglyceric acid is_a: CHEBI:22300 ! aldonic acid phosphate [Term] id: CHEBI:24347 name: glycerates is_a: CHEBI:33763 ! trionate [Term] id: CHEBI:24353 name: glycerol ether is_a: CHEBI:25698 ! ether [Term] id: CHEBI:24356 name: glycerone phosphates is_a: CHEBI:24358 ! glycerone derivative is_a: CHEBI:35132 ! ketose phosphate [Term] id: CHEBI:24358 name: glycerone derivative is_a: CHEBI:26292 ! propanones is_a: CHEBI:63407 ! ketotriose derivative [Term] id: CHEBI:24360 name: glycerophosphoglycerols is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:24367 name: glycinamide ribonucleotide(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:24372 name: glycine cholesterol esters is_a: CHEBI:24373 ! glycine derivative [Term] id: CHEBI:24373 name: glycine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:24384 name: glycogens is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:24385 name: glycoglycerolipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:24387 name: glycolaldehydes is_a: CHEBI:50413 ! hydroxyaldehyde [Term] id: CHEBI:24396 name: glycopeptide is_a: CHEBI:16670 ! peptide is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:24397 name: glycophospholipid is_a: CHEBI:16247 ! phospholipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:24399 name: glycosaminyl group is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:24400 name: glycoside is_a: CHEBI:63161 ! glycosyl compound [Term] id: CHEBI:24401 name: glycosinolate is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:24402 name: glycosphingolipid is_a: CHEBI:26739 ! sphingolipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:24403 name: glycosyl group is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:24405 name: glycosylglucose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:24406 name: glycosylglycerol is_a: CHEBI:24400 ! glycoside is_a: CHEBI:36307 ! glycosyl alditol [Term] id: CHEBI:24407 name: glycosyl glycoside is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:24409 name: glycosylphosphatidylinositolethanolamine is_a: CHEBI:24410 ! glycosylphosphatidylinositol [Term] id: CHEBI:24410 name: glycosylphosphatidylinositol is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:24397 ! glycophospholipid is_a: CHEBI:28874 ! phosphatidylinositol [Term] id: CHEBI:24431 name: chemical entity subset: chebi_ph7_3 [Term] id: CHEBI:24432 name: biological role is_a: CHEBI:50906 ! role [Term] id: CHEBI:24433 name: group is_a: CHEBI:24431 ! chemical entity relationship: has_part CHEBI:33250 ! atom [Term] id: CHEBI:24436 name: guanidines is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:24439 name: guanidinoacetic acids is_a: CHEBI:21672 ! N-amidino-amino acid is_a: CHEBI:24373 ! glycine derivative [Term] id: CHEBI:24442 name: guanidinoethyl methyl phosphates is_a: CHEBI:24436 ! guanidines is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:24455 name: guanosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate is_a: CHEBI:61295 ! guanyl ribonucleotide [Term] id: CHEBI:24458 name: guanosines is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:24461 name: gulonate is_a: CHEBI:33864 ! gulonates [Term] id: CHEBI:24462 name: gulonic acid is_a: CHEBI:33752 ! hexonic acid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:24469 name: haloalkane is_a: CHEBI:24472 ! halohydrocarbon [Term] id: CHEBI:24470 name: haloamino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:24471 name: halogen molecular entity is_a: CHEBI:33675 ! p-block molecular entity relationship: has_part CHEBI:24473 ! halogen [Term] id: CHEBI:24472 name: halohydrocarbon is_a: CHEBI:17792 ! organohalogen compound [Term] id: CHEBI:24473 name: halogen is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33560 ! p-block element atom [Term] id: CHEBI:24479 name: heme a is_a: CHEBI:30413 ! heme is_a: CHEBI:36178 ! cytoporphyrins relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:2448 name: actinorhodin is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:36820 ! ring assembly is_a: CHEBI:48129 ! benzoisochromanequinone relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:24480 name: heme o subset: chebi_ph7_3 is_a: CHEBI:30413 ! heme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:24495 name: heparan alpha-D-glucosaminide is_a: CHEBI:24500 ! heparan is_a: CHEBI:35373 ! D-glucosaminide is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:24499 name: heparan sulfate proteoglycan is_a: CHEBI:37396 ! proteoglycan is_a: CHEBI:37944 ! polysaccharide sulfate [Term] id: CHEBI:24500 name: heparan is_a: CHEBI:18085 ! glycosaminoglycan [Term] id: CHEBI:24505 name: heparins is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37395 ! mucopolysaccharide [Term] id: CHEBI:24521 name: heptenedioate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:24522 name: heptenedioic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:24523 name: heptenone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:24527 name: herbicide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:24531 name: heterocyclic antibiotic is_a: CHEBI:24532 ! organic heterocyclic compound relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:24532 name: organic heterocyclic compound is_a: CHEBI:33285 ! heteroorganic entity is_a: CHEBI:33832 ! organic cyclic compound is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:24533 name: heterodetic cyclic peptide is_a: CHEBI:23449 ! cyclic peptide [Term] id: CHEBI:24536 name: hexachlorocyclohexane subset: chebi_ph7_3 is_a: CHEBI:39154 ! chlorocyclohexane [Term] id: CHEBI:24545 name: hexadecatrienoic acid is_a: CHEBI:132499 ! fatty acid 16:3 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:24546 name: hexadecen-1-ol is_a: CHEBI:50582 ! alkenyl alcohol is_a: CHEBI:77396 ! long-chain primary fatty alcohol [Term] id: CHEBI:24547 name: hexadecenal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:24548 name: hexadecenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:24549 name: hexadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:24551 name: hexadienal is_a: CHEBI:51688 ! enal [Term] id: CHEBI:24552 name: hexadienedioate is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:24553 name: hexadienedioic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid [Term] id: CHEBI:24554 name: hexadienoate is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:24555 name: hexadienoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:24561 name: hexahydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:24567 name: cyclohexane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol [Term] id: CHEBI:24573 name: hexanone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:24576 name: hexaric acid anion is_a: CHEBI:22289 ! aldaric acid anion [Term] id: CHEBI:24577 name: hexaric acid is_a: CHEBI:22290 ! aldaric acid [Term] id: CHEBI:24578 name: hexenal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde [Term] id: CHEBI:24580 name: hexenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:24582 name: hexitol phosphate is_a: CHEBI:22297 ! alditol phosphate is_a: CHEBI:63430 ! hexitol derivative [Term] id: CHEBI:24583 name: hexitol is_a: CHEBI:17522 ! alditol [Term] id: CHEBI:24584 name: hexosamine phosphate is_a: CHEBI:22529 ! amino sugar phosphate [Term] id: CHEBI:24585 name: hexosamine sulfate is_a: CHEBI:24589 ! monosaccharide sulfate [Term] id: CHEBI:24586 name: hexosamine is_a: CHEBI:60926 ! amino monosaccharide [Term] id: CHEBI:24587 name: hexosaminide is_a: CHEBI:24400 ! glycoside is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:24588 name: hexose 1-phosphate is_a: CHEBI:21037 ! aldohexose phosphate [Term] id: CHEBI:24589 name: monosaccharide sulfate is_a: CHEBI:35724 ! carbohydrate sulfate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:24591 name: hexuronate is_a: CHEBI:33549 ! uronate [Term] id: CHEBI:24592 name: hexuronic acid is_a: CHEBI:27252 ! uronic acid [Term] id: CHEBI:24599 name: histidine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:24610 name: homocysteines is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:24612 name: homocystines is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:24613 name: homodetic cyclic peptide is_a: CHEBI:23449 ! cyclic peptide [Term] id: CHEBI:24619 name: homoserine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:24621 name: hormone is_a: CHEBI:33280 ! molecular messenger is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:24628 name: imidazolidine-2,4-dione is_a: CHEBI:55370 ! imidazolidinone [Term] id: CHEBI:24631 name: hydrazines is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:24632 name: hydrocarbon is_a: CHEBI:33245 ! organic fundamental parent [Term] id: CHEBI:24636 name: proton is_a: CHEBI:15378 ! hydron is_a: CHEBI:33253 ! nucleon [Term] id: CHEBI:246422 name: dUMP(2-) subset: chebi_ph7_3 is_a: CHEBI:142209 ! pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24644 name: HPETE is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:24646 name: hydroquinones subset: chebi_ph7_3 is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:24648 name: hydroxamic acid anion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:24650 name: hydroxamic acid is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:24651 name: hydroxides is_a: CHEBI:25806 ! oxygen molecular entity is_a: CHEBI:33608 ! hydrogen molecular entity is_a: CHEBI:37577 ! heteroatomic molecular entity relationship: has_part CHEBI:43176 ! hydroxy group [Term] id: CHEBI:24654 name: hydroxy fatty acid is_a: CHEBI:35366 ! fatty acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:24658 name: hydroxy-L-arginine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:24659 name: hydroxy-L-glutamic acid is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:24661 name: hydroxy-L-lysine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:25095 ! L-lysine derivative [Term] id: CHEBI:24662 name: hydroxy-amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:24663 name: hydroxy-5beta-cholanic acid is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:36248 ! 5beta-cholanic acids [Term] id: CHEBI:24668 name: hydroxyacetophenone is_a: CHEBI:22187 ! acetophenones is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24669 name: hydroxy carboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24673 name: hydroxybenzaldehyde is_a: CHEBI:22698 ! benzaldehydes is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24675 name: hydroxybenzoate is_a: CHEBI:22718 ! benzoates is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:24676 name: hydroxybenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24677 name: hydroxybenzophenone is_a: CHEBI:22726 ! benzophenones is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24678 name: hydroxybenzoyl-CoA is_a: CHEBI:22736 ! benzoyl-CoAs is_a: CHEBI:33853 ! phenols is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:24679 name: hydroxybenzyl alcohol is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:2468 name: secondary alpha-hydroxy ketone subset: chebi_ph7_3 is_a: CHEBI:139588 ! alpha-hydroxy ketone is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:24681 name: hydroxybiphenyls is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24684 name: hydroxybutyric acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:24685 name: hydroxybutanoyl-CoA is_a: CHEBI:22954 ! butanoyl-CoAs [Term] id: CHEBI:24688 name: monohydroxycinnamic acid is_a: CHEBI:24689 ! hydroxycinnamic acid [Term] id: CHEBI:24689 name: hydroxycinnamic acid is_a: CHEBI:23252 ! cinnamic acids [Term] id: CHEBI:24693 name: hydroxycyclohexanone is_a: CHEBI:23482 ! cyclohexanones [Term] id: CHEBI:24697 name: hydroxyflavanone is_a: CHEBI:28863 ! flavanones is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24698 name: hydroxyflavone is_a: CHEBI:24043 ! flavones is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24699 name: hydroxyfluorenes is_a: CHEBI:24059 ! fluorenes is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24705 name: hydroxykynurenamine is_a: CHEBI:24990 ! kynurenamines [Term] id: CHEBI:24709 name: hydroxylamines is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:24711 name: hydroxymalonate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:24712 name: hydroxymethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:24727 name: hydroxynaphthalene is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24729 name: 6-hydroxynicotine is_a: CHEBI:38182 ! monohydroxypyridine [Term] id: CHEBI:24730 name: hydroxynitrile is_a: CHEBI:18379 ! nitrile [Term] id: CHEBI:24731 name: hydroxyphenylacetaldehyde oxime is_a: CHEBI:22307 ! aldoxime [Term] id: CHEBI:24734 name: hydroxyphenylalanine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:25985 ! phenylalanine derivative is_a: CHEBI:33856 ! aromatic amino acid [Term] id: CHEBI:24741 name: hydroxyproline is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:26273 ! proline derivative is_a: CHEBI:46701 ! pyrrolidinemonocarboxylic acid is_a: CHEBI:46773 ! hydroxypyrrolidine [Term] id: CHEBI:24744 name: 2-hydroxypropyl-CoM is_a: CHEBI:23356 ! S-substituted coenzyme M [Term] id: CHEBI:24745 name: hydroxypyridine is_a: CHEBI:26421 ! pyridines is_a: CHEBI:74818 ! heteroaryl hydroxy compound [Term] id: CHEBI:24747 name: hydroxyoctadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:24751 name: hydroxytoluene is_a: CHEBI:27024 ! toluenes is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24753 name: hygromycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic [Term] id: CHEBI:24757 name: hypochlorous acid subset: chebi_ph7_3 is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:33426 ! chlorine oxoacid relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:76797 ! EC 2.5.1.18 (glutathione transferase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24765 name: idaric acid is_a: CHEBI:24577 ! hexaric acid [Term] id: CHEBI:24766 name: iditol is_a: CHEBI:24583 ! hexitol [Term] id: CHEBI:24768 name: iduronates is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:24769 name: iduronic acid is_a: CHEBI:33897 ! iduronic acids relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24773 name: 3-(imidazol-5-yl)lactate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:24779 name: imidazolylacetaldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:24780 name: imidazoles is_a: CHEBI:23677 ! diazole [Term] id: CHEBI:24781 name: imidazolinone is_a: CHEBI:20432 ! imidazolone is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:24782 name: imide is_a: CHEBI:33257 ! secondary amide [Term] id: CHEBI:24783 name: imine is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:24785 name: iminodiacetate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:24786 name: iminodiacetic acid is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:38161 ! chelator [Term] id: CHEBI:24789 name: indanones is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46940 ! indanes [Term] id: CHEBI:2479 name: adenosylcobinamide guanosyl diphosphate is_a: CHEBI:22260 ! adenosines is_a: CHEBI:33906 ! cobalt corrinoid is_a: CHEBI:37121 ! guanosine 5'-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:24793 name: indoledione is_a: CHEBI:24829 ! indolones [Term] id: CHEBI:24796 name: indolylmethylglucosinolate is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:24797 name: indole phytoalexin is_a: CHEBI:24828 ! indoles relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:2480 name: adenosylcobinamide subset: chebi_ph7_3 is_a: CHEBI:23390 ! cobalt-corrinoid hexaamide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:24803 name: indole-3-acetic acids is_a: CHEBI:24810 ! indol-3-yl carboxylic acid [Term] id: CHEBI:24809 name: indole-3-carboxylic acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:2481 name: adenosylcobinamide phosphate is_a: CHEBI:22260 ! adenosines is_a: CHEBI:37466 ! O-phosphocorrinoid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:24810 name: indol-3-yl carboxylic acid is_a: CHEBI:46867 ! indolyl carboxylic acid [Term] id: CHEBI:24813 name: 3-(indol-3-yl)lactic acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24814 name: indole-3-methanol subset: chebi_ph7_3 is_a: CHEBI:38467 ! indolyl alcohol relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:2482 name: adenosylcob(III)yrinic acid a,c-diamide is_a: CHEBI:33906 ! cobalt corrinoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:24821 name: indolyl carbohydrate is_a: CHEBI:24828 ! indoles is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:24823 name: indoleacetaldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:24828 name: indoles is_a: CHEBI:22728 ! benzopyrrole [Term] id: CHEBI:24829 name: indolones is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:2483 name: adenosylcobyric acid is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:24833 name: oxoacid is_a: CHEBI:24651 ! hydroxides relationship: has_role CHEBI:39141 ! Bronsted acid [Term] id: CHEBI:24834 name: inorganic anion is_a: CHEBI:22563 ! anion is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:24835 name: inorganic molecular entity is_a: CHEBI:23367 ! molecular entity [Term] id: CHEBI:24836 name: inorganic oxide is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:25741 ! oxide [Term] id: CHEBI:24837 name: inorganic peroxide is_a: CHEBI:24836 ! inorganic oxide is_a: CHEBI:25940 ! peroxides [Term] id: CHEBI:24838 name: inorganic phosphate is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:26020 ! phosphate [Term] id: CHEBI:24839 name: inorganic salt is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:24866 ! salt [Term] id: CHEBI:24843 name: inosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:24844 name: inosines is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:24846 name: inositol phosphate is_a: CHEBI:23450 ! cyclitol phosphate [Term] id: CHEBI:24848 name: inositol subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:37206 ! hexol [Term] id: CHEBI:24850 name: insect attractant is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:24852 name: insecticide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:24853 name: intercalator is_a: CHEBI:25435 ! mutagen [Term] id: CHEBI:24859 name: iodine atom subset: chebi_ph7_3 is_a: CHEBI:24473 ! halogen relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:24860 name: iodine molecular entity is_a: CHEBI:24471 ! halogen molecular entity relationship: has_part CHEBI:24859 ! iodine atom [Term] id: CHEBI:24862 name: iodoamino acid is_a: CHEBI:24470 ! haloamino acid is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:24863 name: iodophenol is_a: CHEBI:37142 ! organoiodine compound is_a: CHEBI:38856 ! halophenol [Term] id: CHEBI:24864 name: iodothyronine is_a: CHEBI:24862 ! iodoamino acid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:24865 name: iodotyrosine is_a: CHEBI:24862 ! iodoamino acid is_a: CHEBI:62761 ! tyrosine derivative [Term] id: CHEBI:24866 name: salt is_a: CHEBI:37577 ! heteroatomic molecular entity relationship: has_part CHEBI:22563 ! anion relationship: has_part CHEBI:36916 ! cation [Term] id: CHEBI:24867 name: monoatomic ion is_a: CHEBI:24870 ! ion is_a: CHEBI:33238 ! monoatomic entity [Term] id: CHEBI:24868 name: organic salt is_a: CHEBI:24866 ! salt [Term] id: CHEBI:24869 name: ionophore is_a: CHEBI:38632 ! membrane transport modulator [Term] id: CHEBI:24870 name: ion is_a: CHEBI:23367 ! molecular entity [Term] id: CHEBI:24873 name: iron molecular entity is_a: CHEBI:33744 ! iron group molecular entity relationship: has_part CHEBI:18248 ! iron atom [Term] id: CHEBI:24874 name: iron ionophore is_a: CHEBI:24869 ! ionophore [Term] id: CHEBI:24875 name: iron cation subset: chebi_ph7_3 is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:82663 ! elemental iron relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:24897 name: isoindoles is_a: CHEBI:22728 ! benzopyrrole [Term] id: CHEBI:24898 name: isoleucine is_a: CHEBI:38264 ! 2-amino-3-methylpentanoic acid relationship: has_part CHEBI:45557 ! sec-butyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:24899 name: isoleucine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:2490 name: 6-oxohexanoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:24909 name: hydrocarbyladenosine is_a: CHEBI:22260 ! adenosines [Term] id: CHEBI:24911 name: isopiperitenol subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:24913 name: isoprenoid is_a: CHEBI:18059 ! lipid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:24921 name: isoquinoline alkaloid is_a: CHEBI:22315 ! alkaloid [Term] id: CHEBI:24922 name: isoquinolines is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:24923 name: isoquinolinol is_a: CHEBI:24922 ! isoquinolines is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:24928 name: isothiocyanic acid subset: chebi_ph7_3 is_a: CHEBI:33405 ! hydracid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:24937 name: jasmonates is_a: CHEBI:37848 ! plant hormone [Term] id: CHEBI:24943 name: juvenile hormone is_a: CHEBI:36757 ! farnesane sesquiterpenoid relationship: has_role CHEBI:24621 ! hormone relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:2495 name: adrenosterone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:137626 ! EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:24951 name: kanamycins is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic [Term] id: CHEBI:24957 name: keto-disaccharide is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:24960 name: ketoaldehyde is_a: CHEBI:17087 ! ketone is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:24961 name: ketoaldonate is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:24962 name: ketoaldonic acid phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:24963 name: ketoaldonic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:24964 name: deoxyketohexose phosphate is_a: CHEBI:24972 ! ketohexose phosphate is_a: CHEBI:63350 ! deoxyketohexose derivative [Term] id: CHEBI:24965 name: deoxyketohexose is_a: CHEBI:23639 ! deoxy sugar is_a: CHEBI:24973 ! ketohexose [Term] id: CHEBI:24966 name: keto-D-gluconate is_a: CHEBI:60978 ! ketogluconate [Term] id: CHEBI:24967 name: ketogluconic acid is_a: CHEBI:24266 ! gluconic acid [Term] id: CHEBI:24970 name: ketohexose bisphosphate is_a: CHEBI:24972 ! ketohexose phosphate [Term] id: CHEBI:24971 name: ketohexose monophosphate is_a: CHEBI:24972 ! ketohexose phosphate [Term] id: CHEBI:24972 name: ketohexose phosphate is_a: CHEBI:35132 ! ketose phosphate is_a: CHEBI:47878 ! hexose phosphate [Term] id: CHEBI:24973 name: ketohexose is_a: CHEBI:18133 ! hexose is_a: CHEBI:24978 ! ketose [Term] id: CHEBI:24975 name: ketooctose is_a: CHEBI:24978 ! ketose is_a: CHEBI:25656 ! octose [Term] id: CHEBI:24976 name: ketopentose phosphate is_a: CHEBI:35132 ! ketose phosphate is_a: CHEBI:84055 ! pentose phosphate [Term] id: CHEBI:24977 name: ketopentose is_a: CHEBI:24978 ! ketose is_a: CHEBI:25901 ! pentose [Term] id: CHEBI:24978 name: ketose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:24980 name: ketotetrose phosphate is_a: CHEBI:35132 ! ketose phosphate [Term] id: CHEBI:24981 name: ketotetrose is_a: CHEBI:24978 ! ketose is_a: CHEBI:26938 ! tetrose [Term] id: CHEBI:24982 name: ketotriose is_a: CHEBI:24978 ! ketose is_a: CHEBI:27137 ! triose [Term] id: CHEBI:24983 name: ketoxime subset: chebi_ph7_3 is_a: CHEBI:25750 ! oxime [Term] id: CHEBI:24990 name: kynurenamines is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:24995 name: lactam is_a: CHEBI:23443 ! cyclic amide is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:24996 name: lactate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25000 name: lactone is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35701 ! ester is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:25002 name: lactosamines is_a: CHEBI:22480 ! amino disaccharide [Term] id: CHEBI:25004 name: lactose phosphate is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:25016 name: lead atom subset: chebi_ph7_3 is_a: CHEBI:33306 ! carbon group element atom is_a: CHEBI:33521 ! metal atom [Term] id: CHEBI:25017 name: leucine is_a: CHEBI:22918 ! branched-chain amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:30356 ! isobutyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:25018 name: L-leucine derivative is_a: CHEBI:47003 ! leucine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:25022 name: leucomycin is_a: CHEBI:25106 ! macrolide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:25029 name: leukotriene is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:25036 name: lignan is_a: CHEBI:26004 ! phenylpropanoid [Term] id: CHEBI:2504 name: aflatoxin B1 subset: chebi_ph7_3 is_a: CHEBI:22271 ! aflatoxin is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25040 name: limonene monoterpenoid is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:25046 name: linear tetrapyrrole is_a: CHEBI:26932 ! tetrapyrrole [Term] id: CHEBI:25048 name: linolenic acid is_a: CHEBI:25633 ! octadecatrienoic acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59549 ! essential fatty acid relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:25051 name: lipid As is_a: CHEBI:166828 ! saccharolipid is_a: CHEBI:24397 ! glycophospholipid is_a: CHEBI:35371 ! lipooligosaccharide [Term] id: CHEBI:25072 name: lombricine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:26649 ! serine derivative relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:25078 name: luciferin is_a: CHEBI:52216 ! photobiochemical role [Term] id: CHEBI:25091 name: luteolin O-glucuronoside is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:50018 ! glycosyloxyflavone [Term] id: CHEBI:25094 name: lysine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:35987 ! diamino acid relationship: has_part CHEBI:50339 ! 4-aminobutyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:25095 name: L-lysine derivative is_a: CHEBI:53079 ! lysine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:25097 name: lyxose is_a: CHEBI:33916 ! aldopentose [Term] id: CHEBI:25105 name: macrolide antibiotic is_a: CHEBI:25106 ! macrolide relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:25106 name: macrolide is_a: CHEBI:26188 ! polyketide is_a: CHEBI:63944 ! macrocyclic lactone [Term] id: CHEBI:25107 name: magnesium atom subset: chebi_ph7_3 is_a: CHEBI:22313 ! alkaline earth metal atom relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:25108 name: magnesium molecular entity is_a: CHEBI:33299 ! alkaline earth molecular entity relationship: has_part CHEBI:25107 ! magnesium atom [Term] id: CHEBI:25111 name: magnesium porphyrin is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:38251 ! magnesium tetrapyrrole [Term] id: CHEBI:25115 name: malate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:25136 name: malonyl-CoAs is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:25140 name: maltodextrin is_a: CHEBI:28675 ! dextrin [Term] id: CHEBI:25143 name: maltose phosphate is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:25147 name: mandelate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:25150 name: prunasin subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23436 ! cyanogenic glycoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:25154 name: manganese molecular entity is_a: CHEBI:33743 ! manganese group molecular entity relationship: has_part CHEBI:18291 ! manganese atom [Term] id: CHEBI:25155 name: manganese cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:35115 ! elemental manganese [Term] id: CHEBI:25165 name: mannosamine phosphate is_a: CHEBI:24584 ! hexosamine phosphate [Term] id: CHEBI:25166 name: mannosamine is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:25167 name: mannosaminolactone is_a: CHEBI:37432 ! mannonolactone [Term] id: CHEBI:25168 name: mannosylinositol phosphorylceramide is_a: CHEBI:26057 ! phosphoglycosphingolipid is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:25169 name: mannoside is_a: CHEBI:35313 ! hexoside [Term] id: CHEBI:25171 name: mannosyl groups is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:25174 name: mannooligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:25175 name: mannuronates is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:25176 name: mannuronic acid is_a: CHEBI:33898 ! mannuronic acids [Term] id: CHEBI:25179 name: melanins is_a: CHEBI:26195 ! polyphenol relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:25185 name: menaquinones subset: chebi_ph7_3 is_a: CHEBI:26254 ! prenylnaphthoquinone [Term] id: CHEBI:25186 name: p-menthane monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:25187 name: p-menthan-3-ol subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:25189 name: 1,4-dimercaptobutane-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:22944 ! butanediols is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:2519 name: agroclavine is_a: CHEBI:23943 ! ergot alkaloid [Term] id: CHEBI:25195 name: mercury atom subset: chebi_ph7_3 is_a: CHEBI:33340 ! zinc group element atom [Term] id: CHEBI:25196 name: mercury molecular entity is_a: CHEBI:33673 ! zinc group molecular entity relationship: has_part CHEBI:25195 ! mercury atom [Term] id: CHEBI:25197 name: mercury cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:35113 ! elemental mercury [Term] id: CHEBI:25212 name: metabolite is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:25213 name: metal cation subset: chebi_ph7_3 is_a: CHEBI:23906 ! monoatomic cation is_a: CHEBI:36915 ! inorganic cation [Term] id: CHEBI:25214 name: metal-sulfur cluster is_a: CHEBI:33733 ! heteronuclear cluster relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:25216 name: metalloporphyrin is_a: CHEBI:26214 ! porphyrins is_a: CHEBI:33240 ! coordination entity is_a: CHEBI:33909 ! metallotetrapyrrole [Term] id: CHEBI:25218 name: methacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:25219 name: methacrylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:25223 name: methanesulfonate ester subset: chebi_ph7_3 is_a: CHEBI:48544 ! methanesulfonates is_a: CHEBI:83347 ! organosulfonic ester [Term] id: CHEBI:25224 name: methanesulfonate subset: chebi_ph7_3 is_a: CHEBI:62081 ! 1,1-diunsubstituted alkanesulfonate [Term] id: CHEBI:25230 name: methionine derivative is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:25235 name: monomethoxybenzene is_a: CHEBI:51683 ! methoxybenzenes [Term] id: CHEBI:25236 name: methoxybenzoate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:25238 name: methoxybenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:51683 ! methoxybenzenes [Term] id: CHEBI:25240 name: methoxyflavanone is_a: CHEBI:28863 ! flavanones is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:25241 name: methoxyflavone is_a: CHEBI:24043 ! flavones is_a: CHEBI:25698 ! ether [Term] id: CHEBI:25248 name: methyl ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:25253 name: methyl halides is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:25255 name: methyl methanesulfonate subset: chebi_ph7_3 is_a: CHEBI:25223 ! methanesulfonate ester relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:25263 name: methyl D-galactoside is_a: CHEBI:20961 ! D-galactoside is_a: CHEBI:60982 ! methyl galactoside [Term] id: CHEBI:25264 name: methyl-L-alanine is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:25268 name: methyl-L-methionine is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:25270 name: methyl myo-inositols is_a: CHEBI:23451 ! cyclitol [Term] id: CHEBI:25271 name: methyl-branched fatty acyl-CoA is_a: CHEBI:61912 ! branched-chain fatty acyl-CoA [Term] id: CHEBI:25272 name: methyladenine is_a: CHEBI:20706 ! 6-aminopurines [Term] id: CHEBI:25273 name: methyladenosine is_a: CHEBI:24909 ! hydrocarbyladenosine [Term] id: CHEBI:25274 name: methylamines is_a: CHEBI:22331 ! alkylamines [Term] id: CHEBI:25275 name: methylaniline is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:25280 name: methylbenzoic acid is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:25281 name: methylbenzyl alcohol is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:27024 ! toluenes [Term] id: CHEBI:25282 name: methylbutanal is_a: CHEBI:22939 ! butanals [Term] id: CHEBI:25286 name: methylbutanoyl-CoA is_a: CHEBI:22954 ! butanoyl-CoAs is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA [Term] id: CHEBI:25289 name: methylcatechol is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:25297 name: methylenetetrahydrofolic acid is_a: CHEBI:26907 ! tetrahydrofolic acid [Term] id: CHEBI:25302 name: methyl glycoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:25307 name: methylguanosine is_a: CHEBI:24458 ! guanosines [Term] id: CHEBI:25311 name: methylisocitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:25312 name: 3-methylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25322 name: methylmercury compound is_a: CHEBI:33255 ! alkylmercury compound [Term] id: CHEBI:25324 name: methylnaphthalenes is_a: CHEBI:25477 ! naphthalenes [Term] id: CHEBI:2533 name: alachlor subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:25333 name: pretetramide is_a: CHEBI:26895 ! tetracyclines is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:25336 name: methylpropanoyl-CoA is_a: CHEBI:26296 ! propanoyl-CoAs [Term] id: CHEBI:25340 name: methylpyridines is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:25345 name: methyltetrahydrofolate is_a: CHEBI:67016 ! tetrahydrofolate [Term] id: CHEBI:25347 name: methyluridine is_a: CHEBI:27242 ! uridines [Term] id: CHEBI:25348 name: methylxanthine is_a: CHEBI:26385 ! purine alkaloid [Term] id: CHEBI:25350 name: mevalonate is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:18790 ! (S)-mevalonate relationship: has_part CHEBI:36464 ! (R)-mevalonate [Term] id: CHEBI:25351 name: mevalonic acid is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:17710 ! (R)-mevalonic acid relationship: has_part CHEBI:28880 ! (S)-mevalonic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:25354 name: mineralocorticoid is_a: CHEBI:36699 ! corticosteroid hormone [Term] id: CHEBI:25355 name: mitochondrial respiratory-chain inhibitor is_a: CHEBI:38497 ! respiratory-chain inhibitor [Term] id: CHEBI:25357 name: mitomycin is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:38303 ! azirinopyrroloindole relationship: has_role CHEBI:24853 ! intercalator relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:25362 name: elemental molecule is_a: CHEBI:25367 ! molecule is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:25367 name: molecule is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:25370 name: molybdenum molecular entity is_a: CHEBI:33741 ! chromium group molecular entity relationship: has_part CHEBI:28685 ! molybdenum atom [Term] id: CHEBI:25371 name: molybdic acid is_a: CHEBI:36267 ! molybdenum oxoacid [Term] id: CHEBI:25372 name: molybdopterin cofactor is_a: CHEBI:35203 ! molybdopterins relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:25375 name: monoamine molecular messenger is_a: CHEBI:63534 ! monoamine relationship: has_role CHEBI:33280 ! molecular messenger [Term] id: CHEBI:25380 name: acetylenic fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:25381 name: monoalkyl phosphate is_a: CHEBI:22324 ! alkyl phosphate [Term] id: CHEBI:25384 name: monocarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:25387 name: monohydroxyacetophenone is_a: CHEBI:24668 ! hydroxyacetophenone [Term] id: CHEBI:25388 name: monohydroxybenzoate is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:25389 name: monohydroxybenzoic acid is_a: CHEBI:24676 ! hydroxybenzoic acid [Term] id: CHEBI:25392 name: naphthols is_a: CHEBI:24727 ! hydroxynaphthalene [Term] id: CHEBI:25399 name: cresol is_a: CHEBI:24751 ! hydroxytoluene is_a: CHEBI:87034 ! aromatic fungicide [Term] id: CHEBI:25400 name: monoiodotyrosine is_a: CHEBI:24865 ! iodotyrosine [Term] id: CHEBI:25401 name: monomethoxyflavone is_a: CHEBI:25241 ! methoxyflavone [Term] id: CHEBI:25405 name: monophosphoglyceric acid is_a: CHEBI:24346 ! phosphoglyceric acid [Term] id: CHEBI:25408 name: monoterpene ketone is_a: CHEBI:26872 ! terpene ketone [Term] id: CHEBI:25409 name: monoterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:25411 name: monoterpenols is_a: CHEBI:26874 ! terpenol [Term] id: CHEBI:25412 name: monoterpenyl phosphate is_a: CHEBI:26875 ! terpenyl phosphate [Term] id: CHEBI:25413 name: monounsaturated fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid [Term] id: CHEBI:25414 name: monoatomic monocation subset: chebi_ph7_3 is_a: CHEBI:23906 ! monoatomic cation [Term] id: CHEBI:25418 name: morphinane alkaloid is_a: CHEBI:24921 ! isoquinoline alkaloid [Term] id: CHEBI:25422 name: muconate semialdehyde is_a: CHEBI:26643 ! aldehydic acid [Term] id: CHEBI:25426 name: mugineic acid is_a: CHEBI:25427 ! mugineic acids [Term] id: CHEBI:25427 name: mugineic acids is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:46891 ! azetidinecarboxylic acid relationship: has_role CHEBI:38155 ! phytosiderophore [Term] id: CHEBI:25430 name: monoatomic polycation is_a: CHEBI:23906 ! monoatomic cation [Term] id: CHEBI:25432 name: muramic acids is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:25435 name: mutagen is_a: CHEBI:50902 ! genotoxin [Term] id: CHEBI:25437 name: mycolates is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:25438 name: mycolic acid is_a: CHEBI:35819 ! branched-chain fatty acid [Term] id: CHEBI:25441 name: mycothiols is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:25442 name: mycotoxin is_a: CHEBI:27026 ! toxin is_a: CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:25443 name: myo-inositol bisphosphate is_a: CHEBI:18087 ! myo-inositol polyphosphate [Term] id: CHEBI:25444 name: myo-inositol cyclic phosphate is_a: CHEBI:84140 ! myo-inositol monophosphate derivative [Term] id: CHEBI:25445 name: myo-inositol hexakisphosphates is_a: CHEBI:18087 ! myo-inositol polyphosphate [Term] id: CHEBI:25446 name: myo-inositol monophosphate is_a: CHEBI:25448 ! myo-inositol phosphate [Term] id: CHEBI:25447 name: myo-inositol pentakisphosphate is_a: CHEBI:18087 ! myo-inositol polyphosphate [Term] id: CHEBI:25448 name: myo-inositol phosphate is_a: CHEBI:24846 ! inositol phosphate [Term] id: CHEBI:25449 name: myo-inositol tetrakisphosphate is_a: CHEBI:18087 ! myo-inositol polyphosphate [Term] id: CHEBI:25450 name: myo-inositol trisphosphate is_a: CHEBI:18087 ! myo-inositol polyphosphate [Term] id: CHEBI:25455 name: myristoyl amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:25477 name: naphthalenes is_a: CHEBI:33836 ! benzenoid aromatic compound is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:25478 name: naphthalenesulfonate is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:25479 name: naphthalenone is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:25481 name: naphthoquinone is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:25482 name: naphthoate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:25483 name: naphthoic acid is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:25491 name: nematicide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:25500 name: neopterins is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:25501 name: neoxanthin is_a: CHEBI:35307 ! epoxycarotenol is_a: CHEBI:37602 ! allenes [Term] id: CHEBI:25505 name: neuraminate is_a: CHEBI:25506 ! neuraminates [Term] id: CHEBI:25506 name: neuraminates is_a: CHEBI:63561 ! ketoaldonate derivative [Term] id: CHEBI:25508 name: neuraminic acids is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63394 ! ketoaldonic acid derivative [Term] id: CHEBI:25512 name: neurotransmitter is_a: CHEBI:33280 ! molecular messenger [Term] id: CHEBI:25513 name: neutral glycosphingolipid is_a: CHEBI:24402 ! glycosphingolipid [Term] id: CHEBI:25516 name: nickel cation subset: chebi_ph7_3 is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:60248 ! nickel ion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:25519 name: nickel tetrapyrrole is_a: CHEBI:33909 ! metallotetrapyrrole [Term] id: CHEBI:25520 name: nicotianamine is_a: CHEBI:25427 ! mugineic acids [Term] id: CHEBI:25523 name: NADP is_a: CHEBI:25524 ! NAD(P) [Term] id: CHEBI:25524 name: NAD(P) is_a: CHEBI:37007 ! nicotinamide dinucleotide is_a: CHEBI:61293 ! adenyl nucleotide relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:25526 name: N-glycosylnicotinamide is_a: CHEBI:36979 ! N-glycosylpyridine [Term] id: CHEBI:25527 name: nicotinamide nucleotide is_a: CHEBI:36980 ! pyridine nucleotide [Term] id: CHEBI:25529 name: pyridinecarboxamide is_a: CHEBI:26421 ! pyridines is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:25533 name: N-glycosylnicotinate is_a: CHEBI:36979 ! N-glycosylpyridine [Term] id: CHEBI:25534 name: nicotinic acid nucleotide is_a: CHEBI:36980 ! pyridine nucleotide [Term] id: CHEBI:25540 name: neonicotinoid insectide is_a: CHEBI:24852 ! insecticide is_a: CHEBI:47958 ! nicotinic acetylcholine receptor agonist is_a: CHEBI:50910 ! neurotoxin [Term] id: CHEBI:25548 name: nitrilotriacetate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:39054 ! NTA [Term] id: CHEBI:25550 name: nitroaniline is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:25555 name: nitrogen atom is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33300 ! pnictogen relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:25558 name: organonitrogen heterocyclic antibiotic is_a: CHEBI:24531 ! heterocyclic antibiotic is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:25560 name: nitroglycerol is_a: CHEBI:51080 ! nitrate ester [Term] id: CHEBI:25562 name: nitrophenol is_a: CHEBI:33853 ! phenols is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:25566 name: nitrotoluene is_a: CHEBI:27024 ! toluenes is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:25567 name: nitrous acid subset: chebi_ph7_3 is_a: CHEBI:33455 ! nitrogen oxoacid [Term] id: CHEBI:25572 name: nocardicin is_a: CHEBI:24983 ! ketoxime is_a: CHEBI:27933 ! beta-lactam antibiotic is_a: CHEBI:35627 ! beta-lactam is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:25575 name: nonadienedioate is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion is_a: CHEBI:189846 ! dicarboxylic fatty acid dianion [Term] id: CHEBI:25576 name: nonadienedioic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid [Term] id: CHEBI:25579 name: nonanone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:25585 name: nonmetal atom is_a: CHEBI:33250 ! atom [Term] id: CHEBI:2559 name: aldohexose 6-phosphate is_a: CHEBI:47877 ! hexose 6-phosphate [Term] id: CHEBI:25591 name: norcoclaurine is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:24923 ! isoquinolinol is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:25604 name: nucleotide-(amino alcohol)s is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:25605 name: nucleoside antibiotic is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:25608 name: nucleoside phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester is_a: CHEBI:61120 ! nucleobase-containing molecular entity [Term] id: CHEBI:25609 name: nucleotide-sugar is_a: CHEBI:35241 ! nucleotide-carbohydrate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:25614 name: nylons is_a: CHEBI:61445 ! poly(amide) polymer relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:25622 name: orthoquinones is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:25626 name: octadecadienoate subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25627 name: octadecadienoic acid is_a: CHEBI:140949 ! fatty acid 18:2 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:25629 name: octadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78125 ! fatty acid anion 18:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25633 name: octadecatrienoic acid is_a: CHEBI:132502 ! fatty acid 18:3 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:25634 name: octadecenoic acid is_a: CHEBI:140948 ! fatty acid 18:1 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:25635 name: octadecenynoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25380 ! acetylenic fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:25636 name: octadienediol is_a: CHEBI:23824 ! diol [Term] id: CHEBI:25637 name: octadienoate is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:25639 name: octadienol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:50582 ! alkenyl alcohol [Term] id: CHEBI:25640 name: octamethylcyclotetrasiloxane subset: chebi_ph7_3 is_a: CHEBI:25713 ! organosilicon compound is_a: CHEBI:48144 ! cyclosiloxane [Term] id: CHEBI:25646 name: octanoate subset: chebi_ph7_3 is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78117 ! fatty acid anion 8:0 relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25656 name: octose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:25661 name: oleandomycins is_a: CHEBI:25106 ! macrolide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:25676 name: oligopeptide is_a: CHEBI:16670 ! peptide [Term] id: CHEBI:25681 name: omega-3 fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59549 ! essential fatty acid relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25690 name: ommatin is_a: CHEBI:25692 ! ommochrome [Term] id: CHEBI:25692 name: ommochrome is_a: CHEBI:25970 ! phenoxazine is_a: CHEBI:33659 ! organic aromatic compound relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:25693 name: organic heteromonocyclic compound is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:33670 ! heteromonocyclic compound [Term] id: CHEBI:25696 name: organic anion is_a: CHEBI:22563 ! anion is_a: CHEBI:25699 ! organic ion [Term] id: CHEBI:25697 name: organic cation is_a: CHEBI:25699 ! organic ion is_a: CHEBI:36916 ! cation [Term] id: CHEBI:25698 name: ether subset: chebi_ph7_3 is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:25699 name: organic ion is_a: CHEBI:24870 ! ion is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:25701 name: organic oxide is_a: CHEBI:25741 ! oxide is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:25702 name: organic peroxide is_a: CHEBI:25701 ! organic oxide is_a: CHEBI:25940 ! peroxides [Term] id: CHEBI:25703 name: organic phosphate is_a: CHEBI:25710 ! organophosphorus compound is_a: CHEBI:26020 ! phosphate is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:25704 name: organic sulfate is_a: CHEBI:26820 ! sulfates is_a: CHEBI:37826 ! sulfuric acid derivative [Term] id: CHEBI:25705 name: organochlorine insecticide is_a: CHEBI:38656 ! organochlorine pesticide relationship: has_role CHEBI:24852 ! insecticide [Term] id: CHEBI:25706 name: organomercury compound is_a: CHEBI:25196 ! mercury molecular entity is_a: CHEBI:25707 ! organometallic compound [Term] id: CHEBI:25707 name: organometallic compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:25708 name: organophosphate insecticide is_a: CHEBI:25711 ! organophosphorus insecticide [Term] id: CHEBI:2571 name: aliphatic alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:25710 name: organophosphorus compound is_a: CHEBI:26082 ! phosphorus molecular entity is_a: CHEBI:33285 ! heteroorganic entity [Term] id: CHEBI:25711 name: organophosphorus insecticide is_a: CHEBI:39093 ! organophosphorus pesticide relationship: has_role CHEBI:24852 ! insecticide [Term] id: CHEBI:25712 name: organoselenium compound is_a: CHEBI:26628 ! selenium molecular entity is_a: CHEBI:36962 ! organochalcogen compound [Term] id: CHEBI:25713 name: organosilicon compound is_a: CHEBI:26677 ! silicon molecular entity is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:25715 name: organothiophosphate insecticide is_a: CHEBI:25711 ! organophosphorus insecticide [Term] id: CHEBI:25716 name: organothiophosphorus compound is_a: CHEBI:25710 ! organophosphorus compound is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:25717 name: organotin compound is_a: CHEBI:25707 ! organometallic compound is_a: CHEBI:27008 ! tin molecular entity [Term] id: CHEBI:25718 name: ornithine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:25728 name: osmolyte is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:25741 name: oxide is_a: CHEBI:25806 ! oxygen molecular entity is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:25747 name: oxidized luciferins is_a: CHEBI:25078 ! luciferin [Term] id: CHEBI:25750 name: oxime subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:25753 name: oxo-5beta-cholanic acid is_a: CHEBI:36248 ! 5beta-cholanic acids [Term] id: CHEBI:25754 name: oxo carboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:25781 name: hex-2-enedioate is_a: CHEBI:36191 ! hexenedioate [Term] id: CHEBI:25789 name: hexenedioic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:25798 name: oxopentanoates is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:25799 name: oxopentanoic acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:2580 name: unsaturated fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:25801 name: oxoproline is_a: CHEBI:26273 ! proline derivative is_a: CHEBI:38275 ! pyrrolidinone is_a: CHEBI:46701 ! pyrrolidinemonocarboxylic acid [Term] id: CHEBI:25805 name: oxygen atom subset: chebi_ph7_3 is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33303 ! chalcogen relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:25806 name: oxygen molecular entity is_a: CHEBI:33304 ! chalcogen molecular entity relationship: has_part CHEBI:25805 ! oxygen atom [Term] id: CHEBI:25807 name: organooxygen heterocyclic antibiotic is_a: CHEBI:24531 ! heterocyclic antibiotic [Term] id: CHEBI:25810 name: oxopurine is_a: CHEBI:26401 ! purines [Term] id: CHEBI:25812 name: ozone subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:25362 ! elemental molecule is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:33265 ! triatomic oxygen relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:35204 ! tracer relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:59739 ! electrophilic reagent relationship: has_role CHEBI:63248 ! oxidising agent relationship: has_role CHEBI:76413 ! greenhouse gas [Term] id: CHEBI:25822 name: p-cumate subset: chebi_ph7_3 is_a: CHEBI:23410 ! cumate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:25826 name: p-menthane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:25830 name: p-quinones is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:25835 name: hexadecanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:25838 name: palmitoyl amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:25840 name: palmitoyl-L-cysteine is_a: CHEBI:25838 ! palmitoyl amino acid is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:25842 name: palmityl group subset: chebi_ph7_3 is_a: CHEBI:22323 ! alkyl group [Term] id: CHEBI:25845 name: pantetheines is_a: CHEBI:25848 ! pantothenic acids [Term] id: CHEBI:25848 name: pantothenic acids is_a: CHEBI:22823 ! beta-alanine derivative is_a: CHEBI:37622 ! carboxamide relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:27314 ! water-soluble vitamin (role) [Term] id: CHEBI:25858 name: 1,7-dimethylxanthine subset: chebi_ph7_3 is_a: CHEBI:23818 ! dimethylxanthine relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:25863 name: pelargonidin is_a: CHEBI:140277 ! 5-hydroxyanthocyanidin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:25865 name: penicillanic acids is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:35992 ! penams [Term] id: CHEBI:25872 name: pentacyclic triterpenoid is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:25876 name: pentadienoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid [Term] id: CHEBI:25878 name: pentaerythritol nitrate is_a: CHEBI:51080 ! nitrate ester [Term] id: CHEBI:25879 name: pentaerythritol tetranitrate subset: chebi_ph7_3 is_a: CHEBI:25878 ! pentaerythritol nitrate relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:63490 ! explosive [Term] id: CHEBI:2588 name: Alkylated DNA is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:25881 name: pentahydroxycyclohexanone is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:25883 name: pentahydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:25892 name: pentanone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:25897 name: pentenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:25898 name: pentitol phosphate is_a: CHEBI:22297 ! alditol phosphate is_a: CHEBI:63434 ! pentitol derivative [Term] id: CHEBI:25899 name: pentitol is_a: CHEBI:17522 ! alditol [Term] id: CHEBI:25900 name: aldopentose phosphate is_a: CHEBI:35131 ! aldose phosphate is_a: CHEBI:84055 ! pentose phosphate [Term] id: CHEBI:25901 name: pentose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:25903 name: peptide antibiotic is_a: CHEBI:16670 ! peptide relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:25905 name: peptide hormone is_a: CHEBI:16670 ! peptide relationship: has_role CHEBI:24621 ! hormone [Term] id: CHEBI:25907 name: peptidyl group is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:25909 name: peptidyl-1-thioglycine is_a: CHEBI:25921 ! peptidyl-glycine is_a: CHEBI:26965 ! thioglycines [Term] id: CHEBI:25914 name: peptidyl-amino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:25920 name: peptidyl-glycine cholesteryl ester is_a: CHEBI:24372 ! glycine cholesterol esters is_a: CHEBI:25921 ! peptidyl-glycine [Term] id: CHEBI:25921 name: peptidyl-glycine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:25914 ! peptidyl-amino acid [Term] id: CHEBI:25935 name: hydroperoxyl is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:61073 ! oxygen radical [Term] id: CHEBI:25940 name: peroxides subset: chebi_ph7_3 is_a: CHEBI:25741 ! oxide relationship: has_part CHEBI:29369 ! peroxy group relationship: has_role CHEBI:63248 ! oxidising agent [Term] id: CHEBI:25941 name: peroxynitrite subset: chebi_ph7_3 is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:33458 ! nitrogen oxoanion is_a: CHEBI:62764 ! reactive nitrogen species relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:25942 name: peroxynitrous acid is_a: CHEBI:33455 ! nitrogen oxoacid [Term] id: CHEBI:25944 name: pesticide is_a: CHEBI:33232 ! application [Term] id: CHEBI:2596 name: alliin is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:83824 ! L-cysteine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77307 ! cardioprotective agent [Term] id: CHEBI:25961 name: phenanthrenes is_a: CHEBI:33836 ! benzenoid aromatic compound is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:25970 name: phenoxazine is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:25973 name: phenylacetaldehydes is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:25978 name: phenylacetic acids is_a: CHEBI:22712 ! benzenes is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:25979 name: phenylacetonitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22712 ! benzenes relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:25985 name: phenylalanine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:25990 name: phenylethanolamines is_a: CHEBI:23981 ! ethanolamines [Term] id: CHEBI:25998 name: 3-phenyllactic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:26004 name: phenylpropanoid is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:26008 name: phenylpyruvate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:26013 name: pheromone is_a: CHEBI:26645 ! semiochemical [Term] id: CHEBI:26020 name: phosphate is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:26034 name: phosphatidylinositol 3-phosphate is_a: CHEBI:26036 ! phosphatidylinositol monophosphate [Term] id: CHEBI:26036 name: phosphatidylinositol monophosphate is_a: CHEBI:28765 ! phosphatidylinositol phosphate [Term] id: CHEBI:26044 name: phosphinic acids is_a: CHEBI:36360 ! phosphorus oxoacids and derivatives [Term] id: CHEBI:26045 name: phosphite ion is_a: CHEBI:33461 ! phosphorus oxoanion [Term] id: CHEBI:26051 name: phosphoamino acid is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:26057 name: phosphoglycosphingolipid is_a: CHEBI:24397 ! glycophospholipid is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36526 ! acidic glycosphingolipid [Term] id: CHEBI:26066 name: phosphonate is_a: CHEBI:37588 ! phosphonic acid derivative [Term] id: CHEBI:26069 name: phosphonic acids is_a: CHEBI:36360 ! phosphorus oxoacids and derivatives [Term] id: CHEBI:26073 name: phosphopantetheine is_a: CHEBI:25845 ! pantetheines is_a: CHEBI:37481 ! amidoalkyl phosphate [Term] id: CHEBI:26078 name: phosphoric acid is_a: CHEBI:59698 ! phosphoric acids relationship: has_role CHEBI:33287 ! fertilizer relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:26079 name: phosphoric acid derivative is_a: CHEBI:36359 ! phosphorus oxoacid derivative [Term] id: CHEBI:26082 name: phosphorus molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_part CHEBI:28659 ! phosphorus atom [Term] id: CHEBI:26087 name: photosynthetic electron-transport chain inhibitor is_a: CHEBI:24527 ! herbicide is_a: CHEBI:38496 ! electron-transport chain inhibitor [Term] id: CHEBI:26092 name: phthalate is_a: CHEBI:22712 ! benzenes is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:26094 name: benzenedicarboxylic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:26106 name: phylloquinones is_a: CHEBI:26127 ! phytylnaphthoquinone is_a: CHEBI:26255 ! prenylquinone [Term] id: CHEBI:26115 name: phytoalexin is_a: CHEBI:38231 ! phytotoxin [Term] id: CHEBI:26116 name: phytochromobilin is_a: CHEBI:22869 ! bilins relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:82632 ! phytochrome chromophore [Term] id: CHEBI:26118 name: phytoecdysteroid is_a: CHEBI:26124 ! phytosteroid [Term] id: CHEBI:26119 name: phytoene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:26120 name: phytofluene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:26124 name: phytosteroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:26125 name: phytosterols is_a: CHEBI:15889 ! sterol is_a: CHEBI:26124 ! phytosteroid [Term] id: CHEBI:26127 name: phytylnaphthoquinone is_a: CHEBI:25481 ! naphthoquinone [Term] id: CHEBI:26130 name: biological pigment is_a: CHEBI:52208 ! biophysical role [Term] id: CHEBI:26133 name: pinane monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:26144 name: piperazines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:26145 name: piperideine is_a: CHEBI:26921 ! tetrahydropyridine [Term] id: CHEBI:26147 name: piperidine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26151 ! piperidines [Term] id: CHEBI:26148 name: piperidinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26151 ! piperidines [Term] id: CHEBI:26151 name: piperidines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:26153 name: p-menthadien-3-one is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:26155 name: plant growth regulator is_a: CHEBI:39317 ! growth regulator [Term] id: CHEBI:26167 name: polar amino acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:26172 name: poly(ribitol phosphate)s is_a: CHEBI:26554 ! ribitol phosphate [Term] id: CHEBI:26174 name: poly(N-acetyllactosamine) subset: chebi_ph7_3 is_a: CHEBI:22506 ! aminoglycan relationship: has_role CHEBI:52214 ! ligand relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:26177 name: polyene antibiotic is_a: CHEBI:33822 ! organic hydroxy compound relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:26178 name: polyester macromolecule is_a: CHEBI:33839 ! macromolecule is_a: CHEBI:35701 ! ester [Term] id: CHEBI:26179 name: polyether antibiotic is_a: CHEBI:25807 ! organooxygen heterocyclic antibiotic [Term] id: CHEBI:26185 name: polyprenyl glycosyl phosphate is_a: CHEBI:26187 ! polyprenyl phospho carbohydrate [Term] id: CHEBI:26186 name: polyprenyl phospho oligosaccharide is_a: CHEBI:16916 ! oligosaccharide phosphate is_a: CHEBI:26187 ! polyprenyl phospho carbohydrate [Term] id: CHEBI:26187 name: polyprenyl phospho carbohydrate is_a: CHEBI:16460 ! polyprenol phosphate is_a: CHEBI:24397 ! glycophospholipid is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:26188 name: polyketide is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:26191 name: polyol is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:26195 name: polyphenol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:26196 name: polyphenylpropanoid is_a: CHEBI:26004 ! phenylpropanoid [Term] id: CHEBI:26199 name: polyprenol subset: chebi_ph7_3 is_a: CHEBI:26244 ! prenols [Term] id: CHEBI:26203 name: polyprenol triphosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:26207 name: polyterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26208 name: polyunsaturated fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid [Term] id: CHEBI:26214 name: porphyrins is_a: CHEBI:36309 ! cyclic tetrapyrrole relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:26216 name: potassium atom subset: chebi_ph7_3 is_a: CHEBI:22314 ! alkali metal atom relationship: has_role CHEBI:33937 ! macronutrient relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:26217 name: potassium molecular entity is_a: CHEBI:33296 ! alkali metal molecular entity relationship: has_part CHEBI:26216 ! potassium atom [Term] id: CHEBI:26228 name: precorrin is_a: CHEBI:33913 ! corrinoid [Term] id: CHEBI:26244 name: prenols is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:26248 name: prenyl group subset: chebi_ph7_3 is_a: CHEBI:26249 ! prenyl groups is_a: CHEBI:37614 ! alkenyl group [Term] id: CHEBI:26249 name: prenyl groups is_a: CHEBI:33248 ! hydrocarbyl group [Term] id: CHEBI:26250 name: prenol phosphate is_a: CHEBI:37841 ! isoprenoid phosphate [Term] id: CHEBI:26253 name: polyprenylhydroquinone is_a: CHEBI:24646 ! hydroquinones [Term] id: CHEBI:26254 name: prenylnaphthoquinone subset: chebi_ph7_3 is_a: CHEBI:25481 ! naphthoquinone is_a: CHEBI:26255 ! prenylquinone [Term] id: CHEBI:26255 name: prenylquinone is_a: CHEBI:25830 ! p-quinones [Term] id: CHEBI:26267 name: proanthocyanidin is_a: CHEBI:26848 ! tannin is_a: CHEBI:72720 ! flavonoid oligomer [Term] id: CHEBI:26271 name: proline is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:38260 ! pyrrolidines relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:26273 name: proline derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:26279 name: propan-1-ols is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:26282 name: propanals is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:26284 name: propane-1,2-diols is_a: CHEBI:26288 ! propanediol [Term] id: CHEBI:26287 name: propane-1,3-diols is_a: CHEBI:26288 ! propanediol [Term] id: CHEBI:26288 name: propanediol is_a: CHEBI:13643 ! glycol [Term] id: CHEBI:26292 name: propanones is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:26296 name: propanoyl-CoAs is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:26300 name: propenol is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:26313 name: propynol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:26333 name: prostaglandin is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:26334 name: prostaglandins A subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:51689 ! enone [Term] id: CHEBI:26335 name: prostaglandins B subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone [Term] id: CHEBI:26336 name: prostaglandins C subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin [Term] id: CHEBI:26337 name: prostaglandins D subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:26338 name: prostaglandins E subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:2634 name: amidine is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:26340 name: prostaglandins F subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin [Term] id: CHEBI:26343 name: prostaglandins G subset: chebi_ph7_3 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:26344 name: prostaglandins H subset: chebi_ph7_3 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:26345 name: prostaglandins I subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:47783 ! cyclopentafuran [Term] id: CHEBI:26346 name: prostaglandins J subset: chebi_ph7_3 is_a: CHEBI:26333 ! prostaglandin is_a: CHEBI:51689 ! enone [Term] id: CHEBI:26347 name: prostanoid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:26348 name: prosthetic group is_a: CHEBI:23357 ! cofactor [Term] id: CHEBI:26349 name: proteochondroitin sulfate is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37396 ! proteoglycan [Term] id: CHEBI:26354 name: protochlorophyllides is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:26355 name: heme b subset: chebi_ph7_3 is_a: CHEBI:30413 ! heme is_a: CHEBI:36158 ! metalloprotoporphyrin [Term] id: CHEBI:26361 name: protoporphyrins is_a: CHEBI:26214 ! porphyrins [Term] id: CHEBI:26366 name: pseudouridines is_a: CHEBI:36991 ! C-glycosyl pyrimidine [Term] id: CHEBI:26369 name: psoralens is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:26373 name: pteridines is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:33833 ! heteroarene is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:26374 name: pterin is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:26375 name: pterins is_a: CHEBI:26373 ! pteridines [Term] id: CHEBI:26377 name: pterocarpans subset: chebi_ph7_3 is_a: CHEBI:38834 ! benzofurochromene is_a: CHEBI:72544 ! flavonoids [Term] id: CHEBI:26381 name: p-menth-4(8)-en-3-one subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:26384 name: pullulans is_a: CHEBI:24384 ! glycogens [Term] id: CHEBI:26385 name: purine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26401 ! purines [Term] id: CHEBI:26386 name: purine nucleobase subset: chebi_ph7_3 is_a: CHEBI:18282 ! nucleobase is_a: CHEBI:26401 ! purines [Term] id: CHEBI:26387 name: purine 2'-deoxyribonucleoside diphosphate is_a: CHEBI:17955 ! 2'-deoxyribonucleoside diphosphate is_a: CHEBI:26391 ! purine nucleoside diphosphate [Term] id: CHEBI:26388 name: purine 2'-deoxyribonucleoside monophosphate is_a: CHEBI:19257 ! 2'-deoxyribonucleoside monophosphate is_a: CHEBI:26392 ! purine nucleoside monophosphate [Term] id: CHEBI:26389 name: purine deoxyribonucleoside triphosphate is_a: CHEBI:16516 ! 2'-deoxyribonucleoside triphosphate is_a: CHEBI:26393 ! purine nucleoside triphosphate [Term] id: CHEBI:26390 name: purine 2'-deoxyribonucleotide is_a: CHEBI:19260 ! 2'-deoxyribonucleotide is_a: CHEBI:26395 ! purine nucleotide [Term] id: CHEBI:26391 name: purine nucleoside diphosphate is_a: CHEBI:16862 ! nucleoside 5'-diphosphate [Term] id: CHEBI:26392 name: purine nucleoside monophosphate is_a: CHEBI:17188 ! nucleoside 5'-monophosphate [Term] id: CHEBI:26393 name: purine nucleoside triphosphate is_a: CHEBI:17326 ! nucleoside 5'-triphoshate [Term] id: CHEBI:26394 name: purine nucleoside is_a: CHEBI:26401 ! purines is_a: CHEBI:33838 ! nucleoside [Term] id: CHEBI:26395 name: purine nucleotide is_a: CHEBI:26401 ! purines is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:26396 name: purine ribonucleoside diphosphate is_a: CHEBI:17668 ! ribonucleoside diphosphate is_a: CHEBI:26391 ! purine nucleoside diphosphate [Term] id: CHEBI:26397 name: purine ribonucleoside monophosphate is_a: CHEBI:26392 ! purine nucleoside monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate [Term] id: CHEBI:26398 name: purine ribonucleoside triphosphate is_a: CHEBI:17972 ! ribonucleoside triphosphate is_a: CHEBI:26393 ! purine nucleoside triphosphate [Term] id: CHEBI:26399 name: purine ribonucleoside subset: chebi_ph7_3 is_a: CHEBI:18254 ! ribonucleoside is_a: CHEBI:26394 ! purine nucleoside [Term] id: CHEBI:26400 name: purine ribonucleotide is_a: CHEBI:26395 ! purine nucleotide is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:26401 name: purines subset: chebi_ph7_3 is_a: CHEBI:35875 ! imidazopyrimidine [Term] id: CHEBI:26404 name: puromycins is_a: CHEBI:22260 ! adenosines relationship: has_role CHEBI:25605 ! nucleoside antibiotic [Term] id: CHEBI:26406 name: N-substituted putrescine is_a: CHEBI:50441 ! N-substituted diamine [Term] id: CHEBI:26407 name: pyrans is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:26410 name: pyrazoles is_a: CHEBI:23677 ! diazole [Term] id: CHEBI:26413 name: pyrethroid insecticide is_a: CHEBI:24852 ! insecticide is_a: CHEBI:39000 ! sodium channel modulator [Term] id: CHEBI:26414 name: pyridazinone is_a: CHEBI:37921 ! pyridazines [Term] id: CHEBI:26416 name: pyridine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:26420 name: pyridinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26421 ! pyridines is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:26421 name: pyridines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:26432 name: pyrimidine nucleobase subset: chebi_ph7_3 is_a: CHEBI:18282 ! nucleobase is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:26433 name: pyrimidine 2'-deoxyribonucleoside diphosphate is_a: CHEBI:17955 ! 2'-deoxyribonucleoside diphosphate is_a: CHEBI:26437 ! pyrimidine nucleoside diphosphate [Term] id: CHEBI:26434 name: pyrimidine 2'-deoxyribonucleoside monophosphate is_a: CHEBI:19257 ! 2'-deoxyribonucleoside monophosphate is_a: CHEBI:26438 ! pyrimidine nucleoside monophosphate [Term] id: CHEBI:26435 name: pyrimidine deoxyribonucleoside triphosphate is_a: CHEBI:26439 ! pyrimidine nucleoside triphosphate [Term] id: CHEBI:26436 name: pyrimidine 2'-deoxyribonucleotide is_a: CHEBI:19260 ! 2'-deoxyribonucleotide is_a: CHEBI:26441 ! pyrimidine nucleotide [Term] id: CHEBI:26437 name: pyrimidine nucleoside diphosphate is_a: CHEBI:16862 ! nucleoside 5'-diphosphate [Term] id: CHEBI:26438 name: pyrimidine nucleoside monophosphate is_a: CHEBI:17188 ! nucleoside 5'-monophosphate [Term] id: CHEBI:26439 name: pyrimidine nucleoside triphosphate is_a: CHEBI:17326 ! nucleoside 5'-triphoshate [Term] id: CHEBI:26440 name: pyrimidine nucleoside is_a: CHEBI:33838 ! nucleoside is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:26441 name: pyrimidine nucleotide is_a: CHEBI:36976 ! nucleotide is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:26442 name: pyrimidine ribonucleoside diphosphate is_a: CHEBI:17668 ! ribonucleoside diphosphate is_a: CHEBI:26437 ! pyrimidine nucleoside diphosphate [Term] id: CHEBI:26443 name: pyrimidine ribonucleoside monophosphate is_a: CHEBI:26438 ! pyrimidine nucleoside monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate [Term] id: CHEBI:26444 name: pyrimidine ribonucleoside triphosphate is_a: CHEBI:17972 ! ribonucleoside triphosphate is_a: CHEBI:26439 ! pyrimidine nucleoside triphosphate [Term] id: CHEBI:26446 name: pyrimidine ribonucleotide is_a: CHEBI:26441 ! pyrimidine nucleotide is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:26447 name: pyrimidinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:78574 ! pyrimidinecarboxylic acid [Term] id: CHEBI:26452 name: pyrrolecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:26454 name: pyrrolecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26455 ! pyrroles [Term] id: CHEBI:26455 name: pyrroles is_a: CHEBI:68452 ! azole [Term] id: CHEBI:26456 name: pyrrolidine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:38260 ! pyrrolidines [Term] id: CHEBI:26457 name: 1-pyrrolinecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:26461 name: pyrroloquinoline cofactor is_a: CHEBI:50918 ! pyrroloquinoline relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:26463 name: pyruvate family amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid [Term] id: CHEBI:26469 name: quaternary nitrogen compound is_a: CHEBI:35352 ! organonitrogen compound relationship: has_part CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:26481 name: quercetin bissulfate is_a: CHEBI:26482 ! quercetin sulfate [Term] id: CHEBI:26482 name: quercetin sulfate is_a: CHEBI:37840 ! hydroxyflavone sulfate [Term] id: CHEBI:26483 name: quercetin trissulfate is_a: CHEBI:26482 ! quercetin sulfate [Term] id: CHEBI:26490 name: quinate is_a: CHEBI:36125 ! cyclitol carboxylic acid anion [Term] id: CHEBI:26493 name: quinic acid is_a: CHEBI:36123 ! cyclitol carboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:26507 name: dihydroxyquinoline is_a: CHEBI:38774 ! hydroxyquinoline [Term] id: CHEBI:26508 name: quinoline N-oxide is_a: CHEBI:26513 ! quinolines is_a: CHEBI:35580 ! N-oxide [Term] id: CHEBI:26509 name: quinoline alkaloid is_a: CHEBI:22315 ! alkaloid [Term] id: CHEBI:2651 name: alpha-aminoacyl-tRNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:26512 name: quinolinemonocarboxylic acid is_a: CHEBI:26513 ! quinolines is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:26513 name: quinolines is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:26515 name: quinolizidine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26516 ! quinolizidines [Term] id: CHEBI:26516 name: quinolizidines is_a: CHEBI:38063 ! quinolizines [Term] id: CHEBI:26519 name: radical is_a: CHEBI:23367 ! molecular entity [Term] id: CHEBI:26523 name: reactive oxygen species is_a: CHEBI:25806 ! oxygen molecular entity [Term] id: CHEBI:26533 name: reticuline is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:24923 ! isoquinolinol is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:26534 name: retinals is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:26537 ! retinoid [Term] id: CHEBI:26536 name: retinoic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:26537 name: retinoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:26543 name: rhamnogalacturonan is_a: CHEBI:24174 ! galacturonan [Term] id: CHEBI:26544 name: rhamnonate is_a: CHEBI:33865 ! rhamnonates [Term] id: CHEBI:26545 name: rhamnonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:26546 name: rhamnose is_a: CHEBI:33983 ! deoxymannose relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:26547 name: rhamnoside is_a: CHEBI:35315 ! deoxy hexoside [Term] id: CHEBI:26548 name: rhamnosylglucoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:26554 name: ribitol phosphate is_a: CHEBI:25898 ! pentitol phosphate [Term] id: CHEBI:26556 name: 1-ribosylimidazolecarboxamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:37293 ! 1-ribosylimidazole [Term] id: CHEBI:26558 name: ribonucleoside monophosphate is_a: CHEBI:17188 ! nucleoside 5'-monophosphate [Term] id: CHEBI:26561 name: ribonucleotide is_a: CHEBI:26562 ! ribose phosphate is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:26562 name: ribose phosphate is_a: CHEBI:25900 ! aldopentose phosphate [Term] id: CHEBI:26563 name: ribose triphosphate is_a: CHEBI:26562 ! ribose phosphate [Term] id: CHEBI:26568 name: ribosylamine is_a: CHEBI:21731 ! N-glycosyl compound [Term] id: CHEBI:26573 name: ribulose phosphate is_a: CHEBI:33956 ! ribulose derivative [Term] id: CHEBI:26580 name: rifamycins is_a: CHEBI:22565 ! ansamycin is_a: CHEBI:39270 ! naphthofuran [Term] id: CHEBI:26587 name: rutinoside is_a: CHEBI:26548 ! rhamnosylglucoside [Term] id: CHEBI:26588 name: 1,3,5-triazines is_a: CHEBI:38102 ! triazines [Term] id: CHEBI:26590 name: sabinol subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:26596 name: salicylates is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:26600 name: salutaridinol is_a: CHEBI:25418 ! morphinane alkaloid [Term] id: CHEBI:26604 name: santonin is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:39270 ! naphthofuran relationship: has_role CHEBI:35443 ! anthelminthic drug [Term] id: CHEBI:26605 name: saponin is_a: CHEBI:24400 ! glycoside relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:26606 name: sapogenin is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:26607 name: saturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:26613 name: scyllo-inositol phosphate is_a: CHEBI:24846 ! inositol phosphate [Term] id: CHEBI:26616 name: seco-androstane is_a: CHEBI:35788 ! seco-steroid [Term] id: CHEBI:26628 name: selenium molecular entity is_a: CHEBI:33304 ! chalcogen molecular entity relationship: has_part CHEBI:27568 ! selenium atom [Term] id: CHEBI:26629 name: selenoamino acid is_a: CHEBI:25712 ! organoselenium compound [Term] id: CHEBI:26630 name: selenocystathionine is_a: CHEBI:23505 ! cystathionines is_a: CHEBI:26629 ! selenoamino acid [Term] id: CHEBI:26632 name: selenocysteines is_a: CHEBI:26629 ! selenoamino acid [Term] id: CHEBI:26634 name: selenodiglutathione is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:64726 ! thioselenide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:26640 name: selenomethionines is_a: CHEBI:26628 ! selenium molecular entity [Term] id: CHEBI:26642 name: selenous acid is_a: CHEBI:33489 ! selenium oxoacid [Term] id: CHEBI:26643 name: aldehydic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:26645 name: semiochemical is_a: CHEBI:33280 ! molecular messenger [Term] id: CHEBI:26649 name: serine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:26650 name: serine family amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid [Term] id: CHEBI:26658 name: sesquiterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26660 name: sesterterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26666 name: short-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:26667 name: sialic acid is_a: CHEBI:25508 ! neuraminic acids [Term] id: CHEBI:26672 name: siderophore is_a: CHEBI:23357 ! cofactor is_a: CHEBI:24028 ! iron(3+) chelator is_a: CHEBI:24874 ! iron ionophore [Term] id: CHEBI:26673 name: organosilanediol is_a: CHEBI:25713 ! organosilicon compound is_a: CHEBI:46890 ! silicon hydroxide [Term] id: CHEBI:26675 name: silicic acid subset: chebi_ph7_3 is_a: CHEBI:33328 ! silicon oxoacid [Term] id: CHEBI:26677 name: silicon molecular entity is_a: CHEBI:33582 ! carbon group molecular entity relationship: has_part CHEBI:27573 ! silicon atom [Term] id: CHEBI:26689 name: singlet dioxygen subset: chebi_ph7_3 is_a: CHEBI:15379 ! dioxygen is_a: CHEBI:26523 ! reactive oxygen species [Term] id: CHEBI:26706 name: sn-glycerol 3-phosphates is_a: CHEBI:26707 ! glycerol phosphate [Term] id: CHEBI:26707 name: glycerol phosphate is_a: CHEBI:22297 ! alditol phosphate [Term] id: CHEBI:26708 name: sodium atom subset: chebi_ph7_3 is_a: CHEBI:22314 ! alkali metal atom relationship: has_role CHEBI:33937 ! macronutrient relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:26712 name: sodium molecular entity is_a: CHEBI:33296 ! alkali metal molecular entity relationship: has_part CHEBI:26708 ! sodium atom [Term] id: CHEBI:26714 name: sodium salt is_a: CHEBI:26712 ! sodium molecular entity is_a: CHEBI:35479 ! alkali metal salt relationship: has_part CHEBI:29101 ! sodium(1+) [Term] id: CHEBI:26725 name: glucitol phosphate is_a: CHEBI:24582 ! hexitol phosphate [Term] id: CHEBI:26735 name: substituted spermine is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:26738 name: sphingenine is_a: CHEBI:46963 ! 2-aminooctadecene-1,3-diol [Term] id: CHEBI:26739 name: sphingolipid is_a: CHEBI:18059 ! lipid is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:26743 name: sphing-4-enine is_a: CHEBI:26738 ! sphingenine is_a: CHEBI:46964 ! 2-aminooctadec-4-ene-1,3-diol [Term] id: CHEBI:26745 name: spirostan subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent is_a: CHEBI:37948 ! oxaspiro compound [Term] id: CHEBI:26747 name: squalene triterpenoid is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:26759 name: sterigmatocystins is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38180 ! polycyclic heteroarene relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:26761 name: steroid antibiotic is_a: CHEBI:35341 ! steroid is_a: CHEBI:49319 ! carbocyclic antibiotic [Term] id: CHEBI:26763 name: steroid glucosiduronic acid is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:26764 name: steroid hormone is_a: CHEBI:35341 ! steroid relationship: has_role CHEBI:24621 ! hormone [Term] id: CHEBI:26766 name: steroid lactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:26767 name: steroid alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:26773 name: stigmastane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:26775 name: stilbene subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:26776 name: stilbenoid is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:26787 name: streptomycin phosphate is_a: CHEBI:26788 ! streptomycins is_a: CHEBI:36974 ! aminoglycoside phosphate [Term] id: CHEBI:26788 name: streptomycins is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic [Term] id: CHEBI:26789 name: streptothricin is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:24436 ! guanidines is_a: CHEBI:24995 ! lactam is_a: CHEBI:37622 ! carboxamide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:2679 name: amphetamine is_a: CHEBI:35338 ! amphetamines is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:42724 ! (R)-amphetamine relationship: has_part CHEBI:4469 ! (S)-amphetamine relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35640 ! adrenergic uptake inhibitor relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:37962 ! adrenergic agent relationship: has_role CHEBI:48560 ! dopaminergic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:51039 ! dopamine uptake inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:26799 name: styrenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:26806 name: succinate is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:26816 name: carbohydrate phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:26819 name: sulfuric ester subset: chebi_ph7_3 is_a: CHEBI:35701 ! ester is_a: CHEBI:37826 ! sulfuric acid derivative [Term] id: CHEBI:26820 name: sulfates is_a: CHEBI:37826 ! sulfuric acid derivative [Term] id: CHEBI:26822 name: sulfide is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:26825 name: sulfobenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:26826 name: dihydroxybenzenesulfonic acid is_a: CHEBI:33555 ! arenesulfonic acid is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:26829 name: sulfoglycolipid is_a: CHEBI:33563 ! glycolipid is_a: CHEBI:35724 ! carbohydrate sulfate is_a: CHEBI:61384 ! sulfolipid [Term] id: CHEBI:26830 name: sulfonium compound is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:26831 name: N,N''-sulfonyldiurea is_a: CHEBI:38038 ! sulfuric amide is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:22180 ! EC 2.2.1.6 (acetolactate synthase) inhibitor [Term] id: CHEBI:26833 name: sulfur atom subset: chebi_ph7_3 is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33303 ! chalcogen relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:26834 name: sulfur-containing amino acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:26835 name: sulfur molecular entity is_a: CHEBI:33304 ! chalcogen molecular entity relationship: has_part CHEBI:26833 ! sulfur atom [Term] id: CHEBI:26836 name: sulfuric acid is_a: CHEBI:33402 ! sulfur oxoacid relationship: has_role CHEBI:35223 ! catalyst [Term] id: CHEBI:26841 name: synthetic auxin is_a: CHEBI:22676 ! auxin is_a: CHEBI:35703 ! xenobiotic [Term] id: CHEBI:26845 name: tagaturonic acid is_a: CHEBI:33899 ! tagaturonic acids [Term] id: CHEBI:26847 name: altraric acid is_a: CHEBI:24577 ! hexaric acid [Term] id: CHEBI:26848 name: tannin is_a: CHEBI:26195 ! polyphenol relationship: has_role CHEBI:74783 ! astringent [Term] id: CHEBI:26849 name: tartaric acid is_a: CHEBI:15674 ! 2,3-dihydroxybutanedioic acid [Term] id: CHEBI:26863 name: teasterone subset: chebi_ph7_3 is_a: CHEBI:26124 ! phytosteroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36866 ! 23-hydroxy steroid is_a: CHEBI:36883 ! 6-oxo steroid [Term] id: CHEBI:26871 name: terpene alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26872 name: terpene ketone is_a: CHEBI:17087 ! ketone is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26873 name: terpenoid is_a: CHEBI:24913 ! isoprenoid [Term] id: CHEBI:26874 name: terpenol is_a: CHEBI:15734 ! primary alcohol [Term] id: CHEBI:26875 name: terpenyl phosphate is_a: CHEBI:26873 ! terpenoid is_a: CHEBI:37841 ! isoprenoid phosphate [Term] id: CHEBI:26876 name: terpineol is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:25411 ! monoterpenols [Term] id: CHEBI:26878 name: tertiary alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:26888 name: tetrachlorobenzene is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:26893 name: tetracyclic triterpenoid is_a: CHEBI:177333 ! organic tetracyclic compound is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:26895 name: tetracyclines is_a: CHEBI:26188 ! polyketide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:26900 name: tetradecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:26901 name: benzyltetrahydroisoquinoline is_a: CHEBI:24922 ! isoquinolines [Term] id: CHEBI:26904 name: tetrahydrocorphin is_a: CHEBI:25519 ! nickel tetrapyrrole is_a: CHEBI:36311 ! corphinoid [Term] id: CHEBI:26907 name: tetrahydrofolic acid is_a: CHEBI:37445 ! folic acids [Term] id: CHEBI:26908 name: tetrahydrofolyl glutamate is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:37445 ! folic acids [Term] id: CHEBI:26911 name: oxolane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:26912 ! oxolanes is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:37407 ! cyclic ether relationship: has_role CHEBI:48358 ! polar aprotic solvent [Term] id: CHEBI:26912 name: oxolanes is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:26914 name: tetrahydromethanopterin is_a: CHEBI:37669 ! methanopterins [Term] id: CHEBI:26916 name: tetrahydronicotinamide adenine dinucleotide is_a: CHEBI:13389 ! NAD [Term] id: CHEBI:26920 name: tetrahydropteroyltri-L-glutamate is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:26921 name: tetrahydropyridine is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:26925 name: naphthalenetetrol is_a: CHEBI:24727 ! hydroxynaphthalene [Term] id: CHEBI:26932 name: tetrapyrrole is_a: CHEBI:33833 ! heteroarene is_a: CHEBI:38077 ! polypyrrole [Term] id: CHEBI:26933 name: tetraric acid is_a: CHEBI:22290 ! aldaric acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:26935 name: tetraterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:26936 name: tetrathionate ion is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:26937 name: monoatomic tetracation subset: chebi_ph7_3 is_a: CHEBI:25430 ! monoatomic polycation [Term] id: CHEBI:26938 name: tetrose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:26945 name: thiamine phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:26948 name: vitamin B1 is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:63048 ! 1,3-thiazolium cation is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:26952 name: thioacetic acid is_a: CHEBI:35737 ! monothiocarboxylic acid [Term] id: CHEBI:26953 name: thioadenosine is_a: CHEBI:22260 ! adenosines is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:26955 name: thiocyanates is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:26959 name: thiocarboxylic ester is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:35701 ! ester [Term] id: CHEBI:26961 name: thiophenes is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:26965 name: thioglycines is_a: CHEBI:24373 ! glycine derivative [Term] id: CHEBI:26975 name: thioribose phosphate is_a: CHEBI:26562 ! ribose phosphate is_a: CHEBI:26976 ! thioribose [Term] id: CHEBI:26976 name: thioribose is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:74864 ! ribose derivative [Term] id: CHEBI:26977 name: thiosulfate is_a: CHEBI:37827 ! thiosulfuric acid derivative [Term] id: CHEBI:26979 name: organic heterotricyclic compound is_a: CHEBI:36688 ! heterotricyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound is_a: CHEBI:51959 ! organic tricyclic compound [Term] id: CHEBI:26980 name: tetritol phosphate is_a: CHEBI:22297 ! alditol phosphate is_a: CHEBI:63435 ! tetritol derivative [Term] id: CHEBI:26981 name: threitol is_a: CHEBI:48299 ! butane-1,2,3,4-tetrol [Term] id: CHEBI:26984 name: threonic acid is_a: CHEBI:49060 ! 2,3,4-trihydroxybutanoic acid [Term] id: CHEBI:26986 name: threonine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:38263 ! 2-amino-3-hydroxybutanoic acid relationship: has_part CHEBI:50341 ! 1-hydroxyethyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:26987 name: threonine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:26992 name: threoses is_a: CHEBI:33915 ! aldotetrose [Term] id: CHEBI:26995 name: thromboxane is_a: CHEBI:26347 ! prostanoid [Term] id: CHEBI:26996 name: thromboxanes B subset: chebi_ph7_3 is_a: CHEBI:26995 ! thromboxane is_a: CHEBI:38131 ! lactol [Term] id: CHEBI:2700 name: anandamide subset: chebi_ph7_3 is_a: CHEBI:134161 ! N-acylethanolamine 20:4 is_a: CHEBI:67197 ! endocannabinoid relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:27001 name: thymidine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:27007 name: tin atom subset: chebi_ph7_3 is_a: CHEBI:33306 ! carbon group element atom is_a: CHEBI:33521 ! metal atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27008 name: tin molecular entity is_a: CHEBI:33582 ! carbon group molecular entity relationship: has_part CHEBI:27007 ! tin atom [Term] id: CHEBI:27013 name: tocopherol is_a: CHEBI:39437 ! tocol [Term] id: CHEBI:27021 name: toluate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:27023 name: toluene-4-sulfonate subset: chebi_ph7_3 is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:27024 name: toluenes is_a: CHEBI:22712 ! benzenes [Term] id: CHEBI:27026 name: toxin is_a: CHEBI:25212 ! metabolite is_a: CHEBI:64909 ! poison [Term] id: CHEBI:27027 name: micronutrient is_a: CHEBI:33284 ! nutrient [Term] id: CHEBI:27066 name: (9R,10R)-9,10-dihydrophenanthrene-9,10-diol subset: chebi_ph7_3 is_a: CHEBI:37470 ! trans-9,10-dihydrophenanthrene-9,10-diol [Term] id: CHEBI:27081 name: transition element atom is_a: CHEBI:33521 ! metal atom [Term] id: CHEBI:27082 name: trehalose subset: chebi_ph7_3 is_a: CHEBI:131401 ! hexopyranosyl hexopyranoside [Term] id: CHEBI:27083 name: trehalose mycolate is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:27084 name: trehalose phosphate is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:27086 name: tributylstannane subset: chebi_ph7_3 is_a: CHEBI:25717 ! organotin compound [Term] id: CHEBI:27092 name: tricarboxylic acid trianion is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:38717 ! carboxylic acid trianion [Term] id: CHEBI:27093 name: tricarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:27096 name: trichlorobenzene is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:27097 name: trichlorocatechol is_a: CHEBI:23138 ! chlorocatechol is_a: CHEBI:27096 ! trichlorobenzene [Term] id: CHEBI:2710 name: androst-5-ene-3beta,17beta-diol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27102 name: trichlorophenol is_a: CHEBI:15258 ! trichlorophenols [Term] id: CHEBI:27105 name: tridecadienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:27114 name: trihydroxy-5beta-cholanic acid is_a: CHEBI:24663 ! hydroxy-5beta-cholanic acid [Term] id: CHEBI:27115 name: trihydroxybenzoic acid is_a: CHEBI:24676 ! hydroxybenzoic acid [Term] id: CHEBI:27116 name: trihydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:27118 name: naphthalenetriol is_a: CHEBI:24727 ! hydroxynaphthalene [Term] id: CHEBI:27119 name: trihydroxytoluene is_a: CHEBI:24751 ! hydroxytoluene [Term] id: CHEBI:27120 name: triihydroxypyridine is_a: CHEBI:24745 ! hydroxypyridine [Term] id: CHEBI:27124 name: trimethoxyflavone is_a: CHEBI:25241 ! methoxyflavone [Term] id: CHEBI:27134 name: trimethylxanthine is_a: CHEBI:25348 ! methylxanthine [Term] id: CHEBI:27135 name: trinitrotoluene is_a: CHEBI:25566 ! nitrotoluene [Term] id: CHEBI:27136 name: triol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:27137 name: triose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:27150 name: trisaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:27153 name: monoatomic trication subset: chebi_ph7_3 is_a: CHEBI:25430 ! monoatomic polycation is_a: CHEBI:64712 ! trivalent inorganic cation [Term] id: CHEBI:2716 name: anethole subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27162 name: tryptamines is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:27164 name: tryptophan derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:27171 name: organic heterobicyclic compound is_a: CHEBI:33672 ! heterobicyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:27173 name: typhasterol subset: chebi_ph7_3 is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:22921 ! brassinosteroid is_a: CHEBI:35347 ! 3alpha-sterol is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:36866 ! 23-hydroxy steroid is_a: CHEBI:36883 ! 6-oxo steroid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27175 name: tyramines is_a: CHEBI:33853 ! phenols is_a: CHEBI:64365 ! aralkylamino compound [Term] id: CHEBI:27177 name: L-tyrosine derivative is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative is_a: CHEBI:84144 ! L-phenylalanine derivative [Term] id: CHEBI:2719 name: Ile(5)-angiotensin II is_a: CHEBI:48432 ! angiotensin II relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27191 name: undecaprenols is_a: CHEBI:26199 ! polyprenol [Term] id: CHEBI:27193 name: undecaprenyl phosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:27194 name: undecaprenyldiphospho-N-acetylmuramoyl peptide is_a: CHEBI:24396 ! glycopeptide is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:27207 name: univalent carboacyl group is_a: CHEBI:37838 ! carboacyl group [Term] id: CHEBI:27208 name: unsaturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:27216 name: urate(2-) is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:46818 ! urate anion [Term] id: CHEBI:27226 name: uric acid is_a: CHEBI:25810 ! oxopurine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27232 name: uridine 5'-phosphate is_a: CHEBI:27237 ! uridine phosphate [Term] id: CHEBI:27237 name: uridine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:27242 name: uridines is_a: CHEBI:39446 ! pyrimidine ribonucleosides [Term] id: CHEBI:27247 name: urocanate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27248 name: urocanic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:23240 ! chromophore relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27252 name: uronic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:27258 name: uroporphyrinogen is_a: CHEBI:36321 ! porphyrinogens is_a: CHEBI:51705 ! octacarboxylic acid [Term] id: CHEBI:27266 name: valine is_a: CHEBI:22918 ! branched-chain amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:30353 ! isopropyl group relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:27267 name: valine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:27273 name: vanadic acid is_a: CHEBI:35166 ! vanadium coordination entity is_a: CHEBI:36265 ! transition element oxoacid [Term] id: CHEBI:27275 name: vanadium molecular entity is_a: CHEBI:33746 ! vanadium group molecular entity relationship: has_part CHEBI:27698 ! vanadium atom [Term] id: CHEBI:27283 name: very long-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:27288 name: vinca alkaloid is_a: CHEBI:65323 ! monoterpenoid indole alkaloid [Term] id: CHEBI:27295 name: violaxanthin is_a: CHEBI:35307 ! epoxycarotenol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27300 name: vitamin D is_a: CHEBI:36853 ! hydroxy seco-steroid relationship: has_role CHEBI:24020 ! fat-soluble vitamin (role) [Term] id: CHEBI:27306 name: vitamin B6 is_a: CHEBI:26421 ! pyridines is_a: CHEBI:75769 ! B vitamin [Term] id: CHEBI:27311 name: volatile oil component is_a: CHEBI:52206 ! biochemical role is_a: CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27314 name: water-soluble vitamin (role) is_a: CHEBI:33229 ! vitamin (role) [Term] id: CHEBI:27323 name: xanthommatins is_a: CHEBI:25690 ! ommatin is_a: CHEBI:39252 ! pyridophenoxazine [Term] id: CHEBI:27325 name: xanthophyll is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:27329 name: xanthosine phosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:27338 name: xylene is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:38975 ! methylbenzene [Term] id: CHEBI:27341 name: xylitol phosphate is_a: CHEBI:25898 ! pentitol phosphate [Term] id: CHEBI:27343 name: xylogalacturonan is_a: CHEBI:24174 ! galacturonan [Term] id: CHEBI:27345 name: xylonate is_a: CHEBI:27346 ! xylonates [Term] id: CHEBI:27346 name: xylonates is_a: CHEBI:33761 ! pentonate [Term] id: CHEBI:27347 name: xylonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:27349 name: xylose phosphate is_a: CHEBI:25900 ! aldopentose phosphate [Term] id: CHEBI:27350 name: xyloside is_a: CHEBI:35312 ! pentoside [Term] id: CHEBI:27351 name: xylosylgalactoside is_a: CHEBI:19946 ! xylosylglycoside [Term] id: CHEBI:27353 name: xylulose is_a: CHEBI:24977 ! ketopentose [Term] id: CHEBI:27354 name: xylulose 5-phosphate is_a: CHEBI:27355 ! xylulose phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:27355 name: xylulose phosphate is_a: CHEBI:24976 ! ketopentose phosphate is_a: CHEBI:33957 ! xylulose derivative [Term] id: CHEBI:27362 name: zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:27363 name: zinc atom subset: chebi_ph7_3 is_a: CHEBI:33340 ! zinc group element atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27364 name: zinc molecular entity is_a: CHEBI:33673 ! zinc group molecular entity relationship: has_part CHEBI:27363 ! zinc atom [Term] id: CHEBI:27365 name: zinc ion is_a: CHEBI:24867 ! monoatomic ion is_a: CHEBI:37253 ! elemental zinc [Term] id: CHEBI:27369 name: zwitterion is_a: CHEBI:51151 ! dipolar compound [Term] id: CHEBI:27372 name: 1D-chiro-inositol subset: chebi_ph7_3 is_a: CHEBI:23098 ! chiro-inositol relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:27374 name: 1L-chiro-inositol subset: chebi_ph7_3 is_a: CHEBI:23098 ! chiro-inositol [Term] id: CHEBI:27376 name: methanesulfonic acid is_a: CHEBI:47901 ! alkanesulfonic acid is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27378 name: (2S,3R)-aldopyranose subset: chebi_ph7_3 is_a: CHEBI:140379 ! an aldopyranose is_a: CHEBI:15693 ! aldose [Term] id: CHEBI:27379 name: 3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27380 name: (1->6)-beta-D-glucan subset: chebi_ph7_3 is_a: CHEBI:28793 ! beta-D-glucan relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:27381 name: 2,2',3-trihydroxydiphenyl ether is_a: CHEBI:33566 ! catechols is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27384 name: 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid is_a: CHEBI:20432 ! imidazolone is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27385 name: tetrachloromethane subset: chebi_ph7_3 is_a: CHEBI:23148 ! chloromethanes is_a: CHEBI:39226 ! chlorocarbon relationship: has_role CHEBI:50908 ! hepatotoxic agent relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:27386 name: cinnamic acid is_a: CHEBI:23252 ! cinnamic acids is_a: CHEBI:26799 ! styrenes relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27389 name: 3-aminoisobutyric acid is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:27390 name: omega-aminoaldehyde is_a: CHEBI:22492 ! amino aldehyde is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:27391 name: 1-pyrroline-3-hydroxy-5-carboxylic acid is_a: CHEBI:19098 ! 1-pyrrolinecarboxylic acid [Term] id: CHEBI:27392 name: UDP-3-O-(3-hydroxytetradecanoyl)-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:27394 name: D-erythro-3-methylmalic acid is_a: CHEBI:23948 ! erythro-3-methylmalic acid [Term] id: CHEBI:27398 name: imidazole-4-acetaldehyde subset: chebi_ph7_3 is_a: CHEBI:24779 ! imidazolylacetaldehyde is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27402 name: (S)-3-hydroxypalmitoyl-CoA is_a: CHEBI:137639 ! long-chain (3S)-hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27404 name: 5,6-dihydroxyindole subset: chebi_ph7_3 is_a: CHEBI:23781 ! dihydroxyindole relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27405 name: streptidine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:61689 ! amino cyclitol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:27406 name: indole-5,6-quinone subset: chebi_ph7_3 is_a: CHEBI:24793 ! indoledione is_a: CHEBI:25622 ! orthoquinones relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27417 name: p-xylene subset: chebi_ph7_3 is_a: CHEBI:27338 ! xylene [Term] id: CHEBI:27418 name: 1,4-naphthoquinone subset: chebi_ph7_3 is_a: CHEBI:132142 ! 1,4-naphthoquinones [Term] id: CHEBI:27422 name: (KDO)2-(lauroyl)-lipid IVA is_a: CHEBI:25051 ! lipid As relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27425 name: N-acetyl-alpha-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:28401 ! N-acetyl-D-glucosaminide [Term] id: CHEBI:27427 name: 5'-dehydroinosine subset: chebi_ph7_3 is_a: CHEBI:24844 ! inosines [Term] id: CHEBI:27432 name: alpha-linolenic acid is_a: CHEBI:25048 ! linolenic acid is_a: CHEBI:25681 ! omega-3 fatty acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27433 name: gibberellin A53 is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27439 name: (KDO)-lipid IVA is_a: CHEBI:25051 ! lipid As relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27442 name: beta-D-fucose subset: chebi_ph7_3 is_a: CHEBI:2179 ! D-fucopyranose [Term] id: CHEBI:27444 name: but-3-yn-1-ol subset: chebi_ph7_3 is_a: CHEBI:22967 ! butyn-1-ols is_a: CHEBI:73477 ! terminal acetylenic compound [Term] id: CHEBI:27445 name: maltohexaose subset: chebi_ph7_3 is_a: CHEBI:62007 ! maltohexaose hexasaccharide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27450 name: 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonic acid is_a: CHEBI:35333 ! 4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid [Term] id: CHEBI:27452 name: styrene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:26799 ! styrenes is_a: CHEBI:51324 ! vinylarene relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27453 name: 3-keto-beta-D-galactose subset: chebi_ph7_3 is_a: CHEBI:24973 ! ketohexose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27457 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)5-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide [Term] id: CHEBI:27458 name: 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:48887 ! bile acid metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27466 name: (S)-3-hydroxytetradecanoyl-CoA is_a: CHEBI:137639 ! long-chain (3S)-hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27468 name: 5,6-dihydrothymine subset: chebi_ph7_3 is_a: CHEBI:38337 ! pyrimidone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27469 name: 2-dehydro-D-gluconic acid is_a: CHEBI:66938 ! keto-D-gluconic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27470 name: folic acid is_a: CHEBI:37445 ! folic acids is_a: CHEBI:51569 ! N-acyl-amino acid relationship: has_role CHEBI:33284 ! nutrient relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27471 name: glycodeoxycholic acid is_a: CHEBI:36255 ! bile acid glycine conjugate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27475 name: cyanidin 3-O-beta-D-galactoside is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:27476 name: beta-D-ribopyranose subset: chebi_ph7_3 is_a: CHEBI:47006 ! D-ribopyranose [Term] id: CHEBI:27477 name: D-valine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:27266 ! valine [Term] id: CHEBI:27479 name: 2'-hydroxydaidzein is_a: CHEBI:38755 ! hydroxyisoflavone relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:27480 name: phenylacetylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27482 name: (R)-coclaurine is_a: CHEBI:23347 ! coclaurine [Term] id: CHEBI:27485 name: prostaglandin J2 is_a: CHEBI:26346 ! prostaglandins J relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27487 name: 3-(imidazol-5-yl)lactic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27491 name: leukotriene F4 is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27493 name: juvenile hormone III subset: chebi_ph7_3 is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:32955 ! epoxide is_a: CHEBI:4986 ! fatty acid methyl ester is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:27499 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosylceramide is_a: CHEBI:36546 ! sialomonoglycosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27503 name: aldehydo-D-mannosamine subset: chebi_ph7_3 is_a: CHEBI:62324 ! D-mannosamine [Term] id: CHEBI:27504 name: mitomycin C is_a: CHEBI:25357 ! mitomycin relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:27505 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA relationship: has_role CHEBI:48887 ! bile acid metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27510 name: umbelliferone subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:39442 ! fluorescent probe relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:27512 name: (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:27513 name: precorrin-6X is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:27514 name: genistein 7-O-beta-D-glucoside is_a: CHEBI:140301 ! 7-hydroxyisoflavones 7-O-beta-D-glucoside [Term] id: CHEBI:27515 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-D-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:142532 ! alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27517 name: (1->2)-beta-D-glucan subset: chebi_ph7_3 is_a: CHEBI:28793 ! beta-D-glucan [Term] id: CHEBI:27518 name: acetylene subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:22339 ! alkyne is_a: CHEBI:73477 ! terminal acetylenic compound [Term] id: CHEBI:27522 name: rutinose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:27530 name: 4-hydroxy-2-oxohexanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:27531 name: gibberellin A44 diacid is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:27532 name: L-cysteine thioether is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:47910 ! S-substituted L-cysteine [Term] id: CHEBI:27533 name: beta-zeacarotene subset: chebi_ph7_3 is_a: CHEBI:139120 ! carotenoid beta-end derivative is_a: CHEBI:35163 ! cyclic carotene [Term] id: CHEBI:27535 name: alpha-D-mannoside subset: chebi_ph7_3 is_a: CHEBI:25169 ! mannoside [Term] id: CHEBI:27537 name: trans-oct-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27539 name: isatin subset: chebi_ph7_3 is_a: CHEBI:24793 ! indoledione relationship: has_role CHEBI:38623 ! EC 1.4.3.4 (monoamine oxidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27540 name: hexanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27541 name: 3',5'-cyclic IMP is_a: CHEBI:18375 ! nucleoside 3',5'-cyclic phosphate is_a: CHEBI:19834 ! 3',5'-cyclic purine nucleotide relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:27543 name: 9H-carbazole subset: chebi_ph7_3 is_a: CHEBI:3391 ! carbazole [Term] id: CHEBI:27544 name: 3,5-dibromo-4-hydroxybenzoate is_a: CHEBI:25388 ! monohydroxybenzoate [Term] id: CHEBI:27545 name: 2,5-dichlorohydroquinone subset: chebi_ph7_3 is_a: CHEBI:23700 ! dichlorohydroquinone relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:27547 name: zeaxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27551 name: 5-methylcytosine subset: chebi_ph7_3 is_a: CHEBI:134207 ! methylcytosine is_a: CHEBI:39447 ! pyrimidines relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27555 name: prostaglandin C2 is_a: CHEBI:26336 ! prostaglandins C relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27560 name: boron atom subset: chebi_ph7_3 is_a: CHEBI:137980 ! metalloid atom is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33317 ! boron group element atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27561 name: oxirane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:38104 ! oxacycle relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27562 name: 20-hydroxy-20-oxoleukotriene B4 is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:27563 name: arsenic atom subset: chebi_ph7_3 is_a: CHEBI:137980 ! metalloid atom is_a: CHEBI:33300 ! pnictogen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27565 name: 4-aminosalicylic acid is_a: CHEBI:22495 ! aminobenzoic acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:33231 ! antitubercular agent [Term] id: CHEBI:27568 name: selenium atom subset: chebi_ph7_3 is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33303 ! chalcogen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27569 name: arabinogalactan is_a: CHEBI:37165 ! galactan [Term] id: CHEBI:27570 name: histidine is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:33856 ! aromatic amino acid relationship: has_part CHEBI:50338 ! 1H-imidazol-4-ylmethyl group relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:27571 name: 3'-ketolactose subset: chebi_ph7_3 is_a: CHEBI:24957 ! keto-disaccharide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27573 name: silicon atom subset: chebi_ph7_3 is_a: CHEBI:137980 ! metalloid atom is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33306 ! carbon group element atom [Term] id: CHEBI:27574 name: N(2)-succinyl-L-ornithine is_a: CHEBI:21815 ! N2-acyl-L-ornithine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27576 name: 19-hydroxyandrost-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36842 ! 19-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27582 name: 16alpha-hydroxyandrost-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27584 name: aldosterone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:25354 ! mineralocorticoid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:36887 ! 18-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:64600 ! C21-steroid hormone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27585 name: selenomethionine is_a: CHEBI:26629 ! selenoamino acid is_a: CHEBI:26640 ! selenomethionines relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27586 name: beta-L-rhamnopyranose subset: chebi_ph7_3 is_a: CHEBI:62346 ! L-rhamnopyranose [Term] id: CHEBI:27590 name: 7-hydroxyflavanone 7-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:13637 ! flavanone 7-O-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:27592 name: ectoine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35359 ! carboxamidine is_a: CHEBI:78715 ! 1,4,5,6-tetrahydropyrimidines relationship: has_role CHEBI:25728 ! osmolyte [Term] id: CHEBI:27594 name: carbon atom subset: chebi_ph7_3 is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33306 ! carbon group element atom relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:27595 name: 11-epi-prostaglandin F2alpha is_a: CHEBI:26340 ! prostaglandins F relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27596 name: N(pros)-methyl-L-histidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27601 name: pteridine subset: chebi_ph7_3 is_a: CHEBI:26373 ! pteridines is_a: CHEBI:35570 ! mancude organic heterobicyclic parent is_a: CHEBI:50893 ! azaarene is_a: CHEBI:52362 ! ortho-fused heteroarene [Term] id: CHEBI:27603 name: 1(F)-alpha-D-galactosylraffinose subset: chebi_ph7_3 is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:27605 name: D-psicose subset: chebi_ph7_3 is_a: CHEBI:33951 ! psicose relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27609 name: coproporphyrin III is_a: CHEBI:23388 ! coproporphyrin relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27612 name: hydantoin subset: chebi_ph7_3 is_a: CHEBI:24628 ! imidazolidine-2,4-dione [Term] id: CHEBI:27613 name: amygdalin subset: chebi_ph7_3 is_a: CHEBI:23436 ! cyanogenic glycoside is_a: CHEBI:24215 ! gentiobioside is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27616 name: psoralen subset: chebi_ph7_3 is_a: CHEBI:26369 ! psoralens relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27617 name: monensin A is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26179 ! polyether antibiotic is_a: CHEBI:59780 ! cyclic hemiketal is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:24869 ! ionophore relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:35818 ! coccidiostat [Term] id: CHEBI:27618 name: chalcone subset: chebi_ph7_3 is_a: CHEBI:23086 ! chalcones is_a: CHEBI:26799 ! styrenes relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:2762 name: antimycin A subset: chebi_ph7_3 is_a: CHEBI:145556 ! macrodiolide is_a: CHEBI:22702 ! benzamides is_a: CHEBI:24079 ! formamides is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:167183 ! piscicide relationship: has_role CHEBI:25355 ! mitochondrial respiratory-chain inhibitor relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:27624 name: prostaglandin B1 is_a: CHEBI:26335 ! prostaglandins B relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27625 name: alpha-D-glucosamine 1-phosphate is_a: CHEBI:24269 ! glucosamine phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27626 name: 3,4-dehydrothiomorpholine-3-carboxylic acid is_a: CHEBI:36223 ! thiomorpholinemonocarboxylic acid is_a: CHEBI:46976 ! 1,4-thiazine [Term] id: CHEBI:27628 name: 4-isopropylbenzyl alcohol subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:25186 ! p-menthane monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:71692 ! insect repellent relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27630 name: precorrin-5 is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:27632 name: acetophenone subset: chebi_ph7_3 is_a: CHEBI:22187 ! acetophenones relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:27633 name: 2,6-dichlorohydroquinone is_a: CHEBI:23700 ! dichlorohydroquinone [Term] id: CHEBI:27636 name: L-glycol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol [Term] id: CHEBI:27638 name: cobalt atom subset: chebi_ph7_3 is_a: CHEBI:33358 ! cobalt group element atom is_a: CHEBI:88184 ! metal allergen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27639 name: (E)-2-benzylidenesuccinyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:27641 name: cycloheximide subset: chebi_ph7_3 is_a: CHEBI:35356 ! dicarboximide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:48589 ! piperidones is_a: CHEBI:49318 ! piperidine antibiotic is_a: CHEBI:87114 ! antibiotic fungicide relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27642 name: methyl tert-butyl ether subset: chebi_ph7_3 is_a: CHEBI:25698 ! ether relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:62803 ! fuel additive [Term] id: CHEBI:27644 name: chlortetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:26895 ! tetracyclines is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:22986 ! calcium ionophore relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:39442 ! fluorescent probe [Term] id: CHEBI:27645 name: dTDP-3-dehydro-4,6-dideoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:27647 name: prostaglandin G2 is_a: CHEBI:26343 ! prostaglandins G relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27648 name: 3-oxohexanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27652 name: 2',3'-cyclic CMP is_a: CHEBI:19218 ! 2',3'-cyclic pyrimidine nucleotide relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27656 name: camptothecin subset: chebi_ph7_3 is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:26509 ! quinoline alkaloid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:48626 ! pyranoindolizinoquinoline relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50276 ! EC 5.99.1.2 (DNA topoisomerase) inhibitor relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27657 name: N-succinyl-L-glutamic 5-semialdehyde is_a: CHEBI:24313 ! glutamic semialdehyde is_a: CHEBI:35735 ! dicarboxylic acid monoamide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27659 name: 2-oxo aldehyde subset: chebi_ph7_3 is_a: CHEBI:24960 ! ketoaldehyde [Term] id: CHEBI:27660 name: pyrrole-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26452 ! pyrrolecarboxylate [Term] id: CHEBI:27666 name: actinomycin D subset: chebi_ph7_3 is_a: CHEBI:15369 ! actinomycin relationship: has_role CHEBI:25435 ! mutagen [Term] id: CHEBI:27667 name: beta-D-galactose subset: chebi_ph7_3 is_a: CHEBI:4139 ! D-galactopyranose relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27668 name: (S)-3-hydroxylauroyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27670 name: 1,2-bis(3,4-dimethoxyphenyl)propane-1,3-diol subset: chebi_ph7_3 is_a: CHEBI:26287 ! propane-1,3-diols [Term] id: CHEBI:27675 name: chlorohydroquinone subset: chebi_ph7_3 is_a: CHEBI:23147 ! chlorohydroquinones is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:27676 name: L-histidinal is_a: CHEBI:22492 ! amino aldehyde is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:27678 name: dTDP-3-dehydro-6-deoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:27680 name: galactomannan is_a: CHEBI:61298 ! D-glucose- and/or D-galactose-substituted mannan [Term] id: CHEBI:27681 name: (S)-2-acetyl-2-hydroxybutanoic acid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:27684 name: phenylmercury acetate subset: chebi_ph7_3 is_a: CHEBI:22648 ! arylmercury compound is_a: CHEBI:22712 ! benzenes [Term] id: CHEBI:27689 name: decanoate subset: chebi_ph7_3 is_a: CHEBI:194240 ! omega-methyl-medium-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:78118 ! fatty acid anion 10:0 relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27691 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27692 name: lipid II is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27693 name: sitosterol subset: chebi_ph7_3 is_a: CHEBI:131703 ! stigmastane sterol is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:188923 ! C29-steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:52303 ! sterol methyltransferase inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27696 name: prostaglandin D1 is_a: CHEBI:26337 ! prostaglandins D relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27698 name: vanadium atom subset: chebi_ph7_3 is_a: CHEBI:33347 ! vanadium group element atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:27700 name: trans-3-enoyl-CoA is_a: CHEBI:20012 ! 3-enoyl-CoA [Term] id: CHEBI:27701 name: oxytetracycline is_a: CHEBI:26895 ! tetracyclines relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27702 name: (R)-norlaudanosoline is_a: CHEBI:28770 ! norlaudanosoline [Term] id: CHEBI:27705 name: delta-carotene subset: chebi_ph7_3 is_a: CHEBI:139115 ! carotenoid epsilon-end derivative is_a: CHEBI:35163 ! cyclic carotene relationship: has_part CHEBI:139114 ! carotenoid psi-end derivative [Term] id: CHEBI:27707 name: beta-D-Galp-(1->3)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22485 ! glucosamine oligosaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:27708 name: diethyl hydrogen phosphate is_a: CHEBI:16648 ! dialkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:27711 name: precorrin-3B is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:27713 name: (5S)-5-amino-3-oxohexanoic acid is_a: CHEBI:35931 ! delta-amino acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:27714 name: 6-acetyl-2-amino-3,7,8,9-tetrahydropyrimido[4,5-b][1,4]diazepin-4-one subset: chebi_ph7_3 is_a: CHEBI:39306 ! pyrimidodiazepine is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:27715 name: 3-chlorocatechol subset: chebi_ph7_3 is_a: CHEBI:23138 ! chlorocatechol is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:27717 name: gibberellin A1 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27721 name: trans-tetradec-2-enoyl-CoA is_a: CHEBI:26900 ! tetradecenoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27726 name: 6-chloro-1,3,5-triazine-2,4-diamine subset: chebi_ph7_3 is_a: CHEBI:38168 ! chloro-1,3,5-triazine is_a: CHEBI:38170 ! diamino-1,3,5-triazine [Term] id: CHEBI:27727 name: androstane-3,17-diol subset: chebi_ph7_3 is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36838 ! 17-hydroxy steroid is_a: CHEBI:50402 ! androstanoid [Term] id: CHEBI:27730 name: D-isoleucine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:24898 ! isoleucine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27731 name: N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:36508 ! glycotriaosylceramide is_a: CHEBI:88278 ! N-acetylhexosaminyl-dihexosylceramide is_a: CHEBI:90085 ! N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Cer relationship: has_part CHEBI:142518 ! beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27732 name: caffeine subset: chebi_ph7_3 is_a: CHEBI:26385 ! purine alkaloid is_a: CHEBI:27134 ! trimethylxanthine relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35498 ! diuretic relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50218 ! EC 3.1.4.* (phosphoric diester hydrolase) inhibitor relationship: has_role CHEBI:50925 ! EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor relationship: has_role CHEBI:53121 ! adenosine A2A receptor antagonist relationship: has_role CHEBI:60809 ! adjuvant relationship: has_role CHEBI:64047 ! food additive relationship: has_role CHEBI:67114 ! ryanodine receptor agonist relationship: has_role CHEBI:71232 ! adenosine receptor antagonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:27735 name: 5-[(5-phospho-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-phospho-beta-D-ribosyl)imidazole-4-carboxamide is_a: CHEBI:37290 ! 1-(phosphoribosyl)imidazolecarboxamide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27740 name: gamma-carotene subset: chebi_ph7_3 is_a: CHEBI:139120 ! carotenoid beta-end derivative is_a: CHEBI:35163 ! cyclic carotene relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:27741 name: 3'-hydroxyflavonoid subset: chebi_ph7_3 is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:27742 name: gibberellin A20 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27744 name: glyphosate is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:44976 ! phosphonic acid relationship: has_role CHEBI:20569 ! EC 2.5.1.19 (3-phosphoshikimate 1-carboxyvinyltransferase) inhibitor relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:33286 ! agrochemical [Term] id: CHEBI:27748 name: D-ribosylnicotinic acid is_a: CHEBI:47896 ! pyridine nucleoside relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27750 name: ethyl acetate subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77706 ! EC 3.4.19.3 (pyroglutamyl-peptidase I) inhibitor [Term] id: CHEBI:27754 name: methacrylyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27757 name: 4-chlorobiphenyl subset: chebi_ph7_3 is_a: CHEBI:36717 ! monochlorobiphenyl [Term] id: CHEBI:27760 name: L-selenocystathionine is_a: CHEBI:26630 ! selenocystathionine [Term] id: CHEBI:27761 name: (S)-prunasin subset: chebi_ph7_3 is_a: CHEBI:25150 ! prunasin [Term] id: CHEBI:27762 name: 3-hydroxypropanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27765 name: (S)-3-hydroxy-3-methyl-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:53338 ! 3-hydroxy-3-methyl-2-oxopentanoate [Term] id: CHEBI:27767 name: 3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone is_a: CHEBI:23798 ! dimethoxyflavone is_a: CHEBI:38684 ! tetrahydroxyflavone [Term] id: CHEBI:27770 name: nonanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:27771 name: 16alpha-hydroxydehydroepiandrosterone subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27772 name: 4-chlorocatechol subset: chebi_ph7_3 is_a: CHEBI:23138 ! chlorocatechol is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:27773 name: cis-3-enoyl-CoA is_a: CHEBI:20012 ! 3-enoyl-CoA [Term] id: CHEBI:27775 name: P(1),P(3)-bis(5'-adenosyl) triphosphate is_a: CHEBI:63739 ! diadenosyl triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27779 name: griseofulvin subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:87113 ! antibiotic antifungal drug is_a: CHEBI:87128 ! benzofuran antifungal drug relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:27780 name: detergent is_a: CHEBI:33232 ! application is_a: CHEBI:35195 ! surfactant [Term] id: CHEBI:27781 name: myristoleic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36004 ! tetradecenoic acid relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor [Term] id: CHEBI:27784 name: gentamycin C1a is_a: CHEBI:28417 ! gentamycin C [Term] id: CHEBI:27786 name: hydroxocobalamin subset: chebi_ph7_3 is_a: CHEBI:23334 ! cobalamins relationship: has_role CHEBI:75835 ! anti-anaemic agent relationship: has_role CHEBI:90749 ! antidote to cyanide poisoning [Term] id: CHEBI:27787 name: 15-cis-phytoene subset: chebi_ph7_3 is_a: CHEBI:26119 ! phytoene [Term] id: CHEBI:27789 name: 1,2-dichloroethane subset: chebi_ph7_3 is_a: CHEBI:36016 ! chloroethanes relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:50908 ! hepatotoxic agent [Term] id: CHEBI:27798 name: nitrobenzene subset: chebi_ph7_3 is_a: CHEBI:48109 ! nitrobenzenes is_a: CHEBI:51132 ! nitroarene [Term] id: CHEBI:27802 name: 2,3-dihydroxybenzenesulfonic acid is_a: CHEBI:26826 ! dihydroxybenzenesulfonic acid [Term] id: CHEBI:27803 name: cis-2-enoyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:27804 name: cyclohexanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:27809 name: L-4-hydroxyglutamic semialdehyde is_a: CHEBI:24313 ! glutamic semialdehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27810 name: resorcinol subset: chebi_ph7_3 is_a: CHEBI:139520 ! phenolic donor is_a: CHEBI:17701 ! benzenediol is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:139492 ! sensitiser relationship: has_role CHEBI:91025 ! erythropoietin inhibitor [Term] id: CHEBI:27811 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27812 name: Se-methyl-L-selenocysteine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84209 ! L-selenocysteine derivative is_a: CHEBI:9068 ! Se-methylselenocysteine relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:27814 name: 12-dehydro-leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:27817 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GlcNAc-(1->3)-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide [Term] id: CHEBI:27819 name: clavaldehyde is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:35627 ! beta-lactam is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27820 name: prostaglandin A2 is_a: CHEBI:26334 ! prostaglandins A relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27821 name: (S)-methylmalonaldehydic acid is_a: CHEBI:16256 ! 2-methyl-3-oxopropanoic acid is_a: CHEBI:26643 ! aldehydic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27822 name: 2-aminobenzimidazole is_a: CHEBI:22715 ! benzimidazoles relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:27823 name: (5-hydroxyindol-3-yl)acetic acid is_a: CHEBI:24803 ! indole-3-acetic acids relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27825 name: 3',5-dihydroxy-3,4',7-trimethoxyflavone is_a: CHEBI:27124 ! trimethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27826 name: (S)-4-hydroxymandelonitrile beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23436 ! cyanogenic glycoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:27827 name: paraoxon subset: chebi_ph7_3 is_a: CHEBI:25708 ! organophosphate insecticide is_a: CHEBI:37558 ! aryl dialkyl phosphate relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27836 name: dodecanal subset: chebi_ph7_3 is_a: CHEBI:142621 ! medium-chain fatty aldehyde is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84587 ! 2,3-saturated fatty aldehyde relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27843 name: cyanidin cation is_a: CHEBI:140277 ! 5-hydroxyanthocyanidin relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:27844 name: 2',3'-cyclic AMP is_a: CHEBI:19217 ! 2',3'-cyclic purine nucleotide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27847 name: 3-iodo-L-tyrosine is_a: CHEBI:25400 ! monoiodotyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:63932 ! EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27848 name: alpha-L-rhamnoside subset: chebi_ph7_3 is_a: CHEBI:26547 ! rhamnoside [Term] id: CHEBI:27849 name: toluene-4-sulfonic acid is_a: CHEBI:27024 ! toluenes is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:27851 name: keto-neuraminic acid is_a: CHEBI:49018 ! neuraminic acid [Term] id: CHEBI:27852 name: 3,4-dihydroxymandelaldehyde subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:50413 ! hydroxyaldehyde relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27855 name: L-erythro-3-methylmalyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:27856 name: acetamide subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:83628 ! N-acylammonia [Term] id: CHEBI:27857 name: (1->4)-beta-D-mannan subset: chebi_ph7_3 is_a: CHEBI:28808 ! mannan is_a: CHEBI:61266 ! hemicellulose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27858 name: precorrin-6Y is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:27859 name: S-methyl-5-thio-alpha-D-ribose 1-phosphate is_a: CHEBI:26975 ! thioribose phosphate is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27865 name: fucosterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:188923 ! C29-steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:62868 ! hepatoprotective agent [Term] id: CHEBI:27867 name: antheraxanthin subset: chebi_ph7_3 is_a: CHEBI:35307 ! epoxycarotenol relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27868 name: 3-oxolauroyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27869 name: chloroacetic acid is_a: CHEBI:16277 ! haloacetic acid is_a: CHEBI:36685 ! chlorocarboxylic acid relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:24527 ! herbicide [Term] id: CHEBI:27871 name: chloroacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:27877 name: N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanine is_a: CHEBI:17149 ! N-acetyl-beta-D-glycosaminyl glycopeptide [Term] id: CHEBI:27879 name: 6-methylpretetramide is_a: CHEBI:25333 ! pretetramide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:27881 name: resveratrol subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:36027 ! stilbenol relationship: has_role CHEBI:140922 ! glioma-associated oncogene inhibitor relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:27884 name: D-fructofuranose 2-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:27887 name: 6-phospho-beta-D-galactoside is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:37549 ! glycoside phosphate is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:27888 name: chlorophyll b is_a: CHEBI:28966 ! chlorophyll relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:27891 name: S-sulfo-L-cysteine is_a: CHEBI:37996 ! organic thiosulfate is_a: CHEBI:47910 ! S-substituted L-cysteine relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27895 name: 2-chloro-cis,cis-muconic acid is_a: CHEBI:38434 ! 2-chloromuconic acid [Term] id: CHEBI:27897 name: tryptophan is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:38631 ! aminoalkylindole relationship: has_part CHEBI:50337 ! 1H-indol-3-ylmethyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:27898 name: cyanidin 3-O-(6-O-glucosyl-2-O-xylosylgalactoside) is_a: CHEBI:27351 ! xylosylgalactoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:27899 name: cisplatin is_a: CHEBI:51214 ! diamminedichloroplatinum relationship: has_role CHEBI:173085 ! ferroptosis inducer relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:50684 ! cross-linking reagent relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:61015 ! nephrotoxin relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:27902 name: tetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27903 name: (2,4,5-trichlorophenoxy)acetic acid is_a: CHEBI:23152 ! chlorophenoxyacetic acid is_a: CHEBI:27096 ! trichlorobenzene relationship: has_role CHEBI:23582 ! defoliant relationship: has_role CHEBI:26841 ! synthetic auxin relationship: has_role CHEBI:60575 ! phenoxy herbicide [Term] id: CHEBI:27904 name: D-erythrose subset: chebi_ph7_3 is_a: CHEBI:33946 ! erythrose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27906 name: ubiquinone-0 subset: chebi_ph7_3 is_a: CHEBI:16389 ! ubiquinones relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27907 name: alpha-L-rhamnopyranose subset: chebi_ph7_3 is_a: CHEBI:62346 ! L-rhamnopyranose relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:27910 name: 7-dehydrodesmosterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27911 name: N(8)-acetylspermidine is_a: CHEBI:22204 ! acetylspermidine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27913 name: L-erythrulose subset: chebi_ph7_3 is_a: CHEBI:23958 ! erythrulose relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27914 name: hydrogenobyrinic acid a,c-diamide is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:27915 name: melamine is_a: CHEBI:38175 ! triamino-1,3,5-triazine relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:27922 name: sorbose is_a: CHEBI:24973 ! ketohexose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27926 name: beta-D-xyloside is_a: CHEBI:27350 ! xyloside [Term] id: CHEBI:27928 name: parathion subset: chebi_ph7_3 is_a: CHEBI:25715 ! organothiophosphate insecticide is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:37512 ! organic thiophosphate relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:33289 ! avicide relationship: has_role CHEBI:37733 ! EC 3.1.1.8 (cholinesterase) inhibitor relationship: has_role CHEBI:38462 ! EC 3.1.1.7 (acetylcholinesterase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27931 name: alpha-maltotriose subset: chebi_ph7_3 is_a: CHEBI:61991 ! maltotriose trisaccharide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27933 name: beta-lactam antibiotic is_a: CHEBI:25558 ! organonitrogen heterocyclic antibiotic is_a: CHEBI:35627 ! beta-lactam [Term] id: CHEBI:27937 name: cob(II)yrinic acid a,c diamide is_a: CHEBI:48033 ! cobyrinic acid a,c diamide [Term] id: CHEBI:27938 name: beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:36507 ! D-galactosyl-N-acetyl-D-glucosaminyl-D-galactosyl-D-glucosylceramide is_a: CHEBI:88069 ! beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Cer relationship: has_part CHEBI:142508 ! beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-yl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27941 name: pullulan is_a: CHEBI:26384 ! pullulans is_a: CHEBI:72813 ! exopolysaccharide [Term] id: CHEBI:27947 name: D-histidine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:27570 ! histidine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:27948 name: dTDP-alpha-D-desosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:27949 name: (E)-sinapaldehyde subset: chebi_ph7_3 is_a: CHEBI:23245 ! cinnamaldehydes is_a: CHEBI:33853 ! phenols is_a: CHEBI:51681 ! dimethoxybenzene relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27951 name: (R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:36948 ! oxoalkyl phosphate is_a: CHEBI:36949 ! hydroxyalkyl phosphate is_a: CHEBI:36952 ! carboxyalkyl phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27955 name: streptamine is_a: CHEBI:61689 ! amino cyclitol [Term] id: CHEBI:27956 name: L-dehydroascorbic acid is_a: CHEBI:17242 ! dehydroascorbic acid is_a: CHEBI:176783 ! vitamin C relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27957 name: hydroxyacetone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26292 ! propanones is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27958 name: cocaine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35640 ! adrenergic uptake inhibitor relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:36333 ! local anaesthetic relationship: has_role CHEBI:38633 ! sodium channel blocker relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor relationship: has_role CHEBI:51039 ! dopamine uptake inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:27961 name: 1,8-cineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:27962 name: pent-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15469 ! alk-2-enoyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:27963 name: (Kdo)2-lipid A (E. coli) is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:27964 name: 5-methyldeoxycytidine 5'-(trihydrogen diphosphate) is_a: CHEBI:37037 ! pyrimidine 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate [Term] id: CHEBI:27967 name: 11beta-hydroxyandrost-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27969 name: mesaconyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27972 name: 2-deoxy-D-gluc-5-ulosonic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:27973 name: D-arabino-hex-3-ulose 6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:27974 name: estriol subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27975 name: L-glyceraldehyde subset: chebi_ph7_3 is_a: CHEBI:5445 ! glyceraldehyde [Term] id: CHEBI:27976 name: prop-2-ynal subset: chebi_ph7_3 is_a: CHEBI:51720 ! ynal is_a: CHEBI:73477 ! terminal acetylenic compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:27977 name: erythronolide B subset: chebi_ph7_3 is_a: CHEBI:23955 ! erythronolide [Term] id: CHEBI:27978 name: 3,4-dihydroxyphenylacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:25973 ! phenylacetaldehydes is_a: CHEBI:33566 ! catechols is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27979 name: all-cis-icosa-8,11,14-trienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:27986 name: nitrosobenzene subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:35800 ! nitroso compound relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:27989 name: cis-dodec-3-enoyl-CoA is_a: CHEBI:23869 ! dodecenoyl-CoA [Term] id: CHEBI:27991 name: benzonitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22712 ! benzenes [Term] id: CHEBI:27993 name: 1,2-di-O-sinapoyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:27994 name: luteolin 7-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:27995 name: 3-methylbenzyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25281 ! methylbenzyl alcohol [Term] id: CHEBI:27996 name: (R)-4-hydroxymandelate subset: chebi_ph7_3 is_a: CHEBI:32804 ! 4-hydroxymandelate [Term] id: CHEBI:27997 name: elaidic acid is_a: CHEBI:36021 ! octadec-9-enoic acid relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:27998 name: tungsten subset: chebi_ph7_3 is_a: CHEBI:33350 ! chromium group element atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:28 name: (R)-linalool subset: chebi_ph7_3 is_a: CHEBI:17580 ! linalool [Term] id: CHEBI:28000 name: N-acetyl-D-hexosaminide subset: chebi_ph7_3 is_a: CHEBI:24587 ! hexosaminide is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:28001 name: vancomycin is_a: CHEBI:24396 ! glycopeptide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28005 name: cyclohex-1-ene-1-carbonyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:28011 name: 2-hydroxy-6-oxocyclohexane-1-carbonyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28013 name: beta-D-fructofuranose 1,6-bisphosphate is_a: CHEBI:37736 ! D-fructofuranose 1,6-bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28017 name: starch is_a: CHEBI:37163 ! glucan relationship: has_part CHEBI:28057 ! amylopectin relationship: has_part CHEBI:28102 ! amylose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28018 name: 3,3',4',5,7-pentahydroxy-8-methoxyflavone is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:25883 ! pentahydroxyflavone is_a: CHEBI:28802 ! flavonols [Term] id: CHEBI:28024 name: cyanic acid is_a: CHEBI:23423 ! pseudohalogen oxoacid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:28026 name: plastoquinol-9 subset: chebi_ph7_3 is_a: CHEBI:62192 ! plastoquinol [Term] id: CHEBI:28031 name: prostaglandin E3 is_a: CHEBI:26338 ! prostaglandins E relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28032 name: 4'-hydroxyacetophenone subset: chebi_ph7_3 is_a: CHEBI:25387 ! monohydroxyacetophenone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:28034 name: beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:20961 ! D-galactoside [Term] id: CHEBI:28037 name: N-acetyl-D-galactosamine subset: chebi_ph7_3 is_a: CHEBI:21601 ! N-acetyl-D-hexosamine is_a: CHEBI:28800 ! N-acetylgalactosamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28038 name: 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid is_a: CHEBI:25340 ! methylpyridines is_a: CHEBI:26420 ! pyridinemonocarboxylic acid is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38187 ! pyridinecarbaldehyde [Term] id: CHEBI:28044 name: phenylalanine is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:33856 ! aromatic amino acid relationship: has_part CHEBI:22744 ! benzyl group relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:28045 name: (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:28047 name: 5beta-cholestane-3alpha,7alpha-diol subset: chebi_ph7_3 is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28050 name: homocarnosine is_a: CHEBI:24599 ! histidine derivative is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:51569 ! N-acyl-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28053 name: melibiose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:91139 ! elastin-laminin receptor agonist [Term] id: CHEBI:28054 name: o-cresol subset: chebi_ph7_3 is_a: CHEBI:25399 ! cresol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:28057 name: amylopectin is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:28058 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:142532 ! alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_part CHEBI:75127 ! alpha-N-acetylneuraminyl-(2->3)-D-galactosyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28059 name: cis-1,2-dithiane-4,5-diol subset: chebi_ph7_3 is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:51652 ! dithianes [Term] id: CHEBI:28061 name: alpha-D-galactose subset: chebi_ph7_3 is_a: CHEBI:4139 ! D-galactopyranose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28063 name: o-xylene subset: chebi_ph7_3 is_a: CHEBI:27338 ! xylene [Term] id: CHEBI:28064 name: cyanidin 3-O-rutinoside is_a: CHEBI:22712 ! benzenes is_a: CHEBI:26587 ! rutinoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:28066 name: gentiobiose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28068 name: all-trans-zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:27362 ! zeta-carotene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:2807 name: arbutin 6-phosphate is_a: CHEBI:22798 ! beta-D-glucoside relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28070 name: uridine 2'-phosphate is_a: CHEBI:27237 ! uridine phosphate is_a: CHEBI:37651 ! pyrimidine ribonucleoside 2'-monophosphate [Term] id: CHEBI:28071 name: (indol-3-ylacetyl)-myo-inositol 3-L-arabinoside subset: chebi_ph7_3 is_a: CHEBI:22601 ! arabinoside is_a: CHEBI:24821 ! indolyl carbohydrate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:28072 name: guanosine 3'-monophosphate is_a: CHEBI:37020 ! purine ribonucleoside 3'-monophosphate is_a: CHEBI:37120 ! guanosine 3'-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28073 name: chromium atom subset: chebi_ph7_3 is_a: CHEBI:33350 ! chromium group element atom is_a: CHEBI:88184 ! metal allergen relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:28077 name: rifampicin is_a: CHEBI:26580 ! rifamycins is_a: CHEBI:38532 ! hydrazone is_a: CHEBI:46847 ! N-iminopiperazine is_a: CHEBI:46920 ! N-methylpiperazine is_a: CHEBI:59779 ! cyclic ketal is_a: CHEBI:72588 ! semisynthetic derivative relationship: has_role CHEBI:171664 ! antiamoebic agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35816 ! leprostatic drug relationship: has_role CHEBI:37416 ! EC 2.7.7.6 (RNA polymerase) inhibitor relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77318 ! pregnane X receptor agonist [Term] id: CHEBI:28080 name: (2Z,4E)-2-hydroxymuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:24552 ! hexadienedioate [Term] id: CHEBI:28082 name: 5alpha-cholestane-3beta,5,6beta-triol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:38194 ! 5alpha-hydroxy steroid [Term] id: CHEBI:28087 name: glycogen is_a: CHEBI:24384 ! glycogens relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28088 name: genistein is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38637 ! tyrosine kinase inhibitor relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:28089 name: N-hydroxytyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:28093 name: borneol subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:28096 name: S-methyl-5-thio-D-ribulose 1-phosphate is_a: CHEBI:23638 ! deoxyribulose phosphate [Term] id: CHEBI:28097 name: chlorobenzene subset: chebi_ph7_3 is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:46787 ! solvent [Term] id: CHEBI:28098 name: kanamycin B is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:28099 name: prostaglandin B2 is_a: CHEBI:26335 ! prostaglandins B relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28100 name: (1->3)-alpha-D-glucan subset: chebi_ph7_3 is_a: CHEBI:22385 ! alpha-D-glucan [Term] id: CHEBI:28101 name: N(1),N(12)-diacetylspermine is_a: CHEBI:22205 ! acetylspermine [Term] id: CHEBI:28102 name: amylose subset: chebi_ph7_3 is_a: CHEBI:37163 ! glucan relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28107 name: 2-isopropylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:132917 ! 2-isopropylmalate is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:28112 name: nickel atom subset: chebi_ph7_3 is_a: CHEBI:33362 ! nickel group element atom is_a: CHEBI:88184 ! metal allergen relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:28113 name: 24,25-dihydrolanosterol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28115 name: methylcobalamin subset: chebi_ph7_3 is_a: CHEBI:140785 ! R-cob(III)alamin is_a: CHEBI:23334 ! cobalamins relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28116 name: 5-guanidino-2-oxopentanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28118 name: muramic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25432 ! muramic acids relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28119 name: 2,3,7,8-tetrachlorodibenzodioxine subset: chebi_ph7_3 is_a: CHEBI:36682 ! polychlorinated dibenzodioxine [Term] id: CHEBI:28120 name: L-fructose is_a: CHEBI:28757 ! fructose [Term] id: CHEBI:28122 name: p-cumic acid is_a: CHEBI:23412 ! cumic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28125 name: all-cis-docosa-4,7,10,13,16,19-hexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:36005 ! docosahexaenoic acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83146 ! Daphnia tenebrosa metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:28129 name: all-trans-phytofluene subset: chebi_ph7_3 is_a: CHEBI:26120 ! phytofluene relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:28130 name: 13,14-dihydro-Delta(12)-prostaglandin J2 is_a: CHEBI:26346 ! prostaglandins J is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:28133 name: S-alkyl-L-cysteine S-oxide is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:28134 name: ammelide subset: chebi_ph7_3 is_a: CHEBI:38169 ! monoamino-1,3,5-triazine is_a: CHEBI:38173 ! dihydroxy-1,3,5-triazine [Term] id: CHEBI:28137 name: D-glycero-D-manno-heptose 1-phosphate is_a: CHEBI:35157 ! aldoheptose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28138 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28140 name: D-quinovose subset: chebi_ph7_3 is_a: CHEBI:33980 ! quinovose [Term] id: CHEBI:28145 name: dibenzofuran subset: chebi_ph7_3 is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:38180 ! polycyclic heteroarene is_a: CHEBI:38922 ! dibenzofurans relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:28146 name: L-xylonate subset: chebi_ph7_3 is_a: CHEBI:27345 ! xylonate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28147 name: N(2')-acetylgentamycin C1a is_a: CHEBI:21805 ! N(2')-acetylgentamycin [Term] id: CHEBI:28151 name: 5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate is_a: CHEBI:23375 ! copalyl diphosphate [Term] id: CHEBI:28157 name: pinocembrin subset: chebi_ph7_3 is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:38749 ! dihydroxyflavanone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:28159 name: D-asparagine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:22653 ! asparagine [Term] id: CHEBI:28161 name: beta-D-xylose subset: chebi_ph7_3 is_a: CHEBI:53455 ! D-xylopyranose [Term] id: CHEBI:28163 name: iron(III) hydroxamate subset: chebi_ph7_3 is_a: CHEBI:5975 ! iron chelate relationship: has_part CHEBI:24648 ! hydroxamic acid anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28164 name: cholesterol beta-epoxide subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:28168 name: 6-oxocyclohex-1-ene-1-carbonyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA [Term] id: CHEBI:28171 name: 5-hydroxytryptophan is_a: CHEBI:84194 ! hydroxytryptophan relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28173 name: sorbose 1-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate is_a: CHEBI:33952 ! sorbose derivative [Term] id: CHEBI:28175 name: beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:142532 ! alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28177 name: theophylline subset: chebi_ph7_3 is_a: CHEBI:23818 ! dimethylxanthine relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:49167 ! anti-asthmatic drug relationship: has_role CHEBI:50218 ! EC 3.1.4.* (phosphoric diester hydrolase) inhibitor relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:51371 ! muscle relaxant relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:71232 ! adenosine receptor antagonist relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28180 name: but-3-ynal subset: chebi_ph7_3 is_a: CHEBI:22968 ! butynal is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde is_a: CHEBI:73477 ! terminal acetylenic compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28181 name: 2',3'-cyclic GMP is_a: CHEBI:19217 ! 2',3'-cyclic purine nucleotide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28185 name: kanamycin C is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:28189 name: isomaltose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28191 name: 6-alpha-maltosylglucose subset: chebi_ph7_3 is_a: CHEBI:146180 ! glucotriose [Term] id: CHEBI:28192 name: 2-demethylmenaquinone subset: chebi_ph7_3 is_a: CHEBI:25481 ! naphthoquinone is_a: CHEBI:25830 ! p-quinones relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28193 name: lupanine is_a: CHEBI:26515 ! quinolizidine alkaloid is_a: CHEBI:32876 ! tertiary amine is_a: CHEBI:77727 ! delta-lactam [Term] id: CHEBI:28194 name: petroselinic acid is_a: CHEBI:36022 ! octadec-6-enoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28195 name: 3alpha-hydroxy-5beta-androstan-17-one subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28196 name: erythromycin B is_a: CHEBI:48923 ! erythromycin [Term] id: CHEBI:28197 name: daidzein is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:131699 ! EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:28199 name: ferrienterobactin(3-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:84734 ! Fe(III)-complexed siderophore relationship: has_part CHEBI:38150 ! enterobactin(6-) relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28200 name: 2-chloroethanol subset: chebi_ph7_3 is_a: CHEBI:23141 ! chloroethanol relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:28201 name: rotenone subset: chebi_ph7_3 is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:72581 ! rotenones relationship: has_role CHEBI:167183 ! piscicide relationship: has_role CHEBI:22917 ! phytogenic insecticide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38498 ! mitochondrial NADH:ubiquinone reductase inhibitor [Term] id: CHEBI:28203 name: N-acetyl-D-phenylalanine is_a: CHEBI:21501 ! N-acetyl-D-amino acid is_a: CHEBI:21626 ! N-acetylphenylalanine is_a: CHEBI:77672 ! N-acyl-D-phenylalanine [Term] id: CHEBI:28205 name: phaseic acid is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28206 name: 2'-hydroxyisoflavones subset: chebi_ph7_3 is_a: CHEBI:38755 ! hydroxyisoflavone [Term] id: CHEBI:28207 name: D-galactosamine 1-phosphate is_a: CHEBI:24154 ! galactosamine phosphate [Term] id: CHEBI:28209 name: 5(S)-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28211 name: gibberellin A44 is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28217 name: acrylonitrile subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:80291 ! aliphatic nitrile relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:28220 name: 2,6-dihydroxypseudooxynicotine is_a: CHEBI:23793 ! dihydroxypyridine is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:28222 name: 1,2,4-trichlorobenzene subset: chebi_ph7_3 is_a: CHEBI:27096 ! trichlorobenzene [Term] id: CHEBI:28223 name: adenosine 2'-phosphate is_a: CHEBI:37649 ! purine ribonucleoside 2'-monophosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:28225 name: D-leucine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:25017 ! leucine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28228 name: S-acetylphosphopantotheine is_a: CHEBI:26073 ! phosphopantetheine [Term] id: CHEBI:28229 name: N(omega)-methyl-L-arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:28230 name: hesperetin subset: chebi_ph7_3 is_a: CHEBI:140332 ! 4'-methoxyflavanones is_a: CHEBI:38738 ! monomethoxyflavanone is_a: CHEBI:38739 ! trihydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28232 name: D-ribose 5-triphosphate is_a: CHEBI:18159 ! ribose 5-triphosphate [Term] id: CHEBI:28233 name: 2,4,6-trihydroxybenzophenone is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:24677 ! hydroxybenzophenone [Term] id: CHEBI:28245 name: (S)-2-amino-6-oxopimelic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:28247 name: 11beta-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:35346 ! 11beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28250 name: 6-O-acetyl-beta-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:28257 name: N-acetyl-alpha-D-galactosaminide subset: chebi_ph7_3 is_a: CHEBI:28761 ! N-acetyl-D-galactosaminide [Term] id: CHEBI:28258 name: vomifoliol subset: chebi_ph7_3 is_a: CHEBI:36739 ! fenchane monoterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28259 name: (S)-3-hydroxyisobutyryl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28260 name: galactose is_a: CHEBI:33917 ! aldohexose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:28261 name: (+)-alpha-pinene subset: chebi_ph7_3 is_a: CHEBI:36740 ! alpha-pinene relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28262 name: dimethyl sulfoxide subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:22063 ! sulfoxide relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:37335 ! MRI contrast agent relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50247 ! antidote relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28263 name: 2,3,5-trichlorobenzene-1,4-diol is_a: CHEBI:23147 ! chlorohydroquinones [Term] id: CHEBI:28264 name: 3-oxooctanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28265 name: coenzyme F430 is_a: CHEBI:25519 ! nickel tetrapyrrole relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:28266 name: fluorene subset: chebi_ph7_3 is_a: CHEBI:35296 ! ortho-fused polycyclic arene is_a: CHEBI:37089 ! ortho-fused tricyclic hydrocarbon [Term] id: CHEBI:28272 name: beta-L-arabinofuranose subset: chebi_ph7_3 is_a: CHEBI:6178 ! L-arabinofuranose [Term] id: CHEBI:28273 name: aldehydo-N-acetyl-D-mannosamine 6-phosphate is_a: CHEBI:16173 ! aldehydo-N-acyl-D-mannosamine 6-phosphate [Term] id: CHEBI:28276 name: (S)-3-hydroxyhexanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28279 name: 6-methylthiopurine subset: chebi_ph7_3 is_a: CHEBI:35666 ! thiopurine [Term] id: CHEBI:28282 name: N-benzyloxycarbonyl-L-leucine is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:25018 ! L-leucine derivative [Term] id: CHEBI:28283 name: capsidiol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:142279 ! sesquiterpene phytoalexin is_a: CHEBI:36753 ! eremophilane sesquiterpenoid relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28286 name: cyclohexane-1,4-dione subset: chebi_ph7_3 is_a: CHEBI:23478 ! cyclohexanedione [Term] id: CHEBI:28291 name: 3-hydroxyisovaleryl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:24685 ! hydroxybutanoyl-CoA is_a: CHEBI:25286 ! methylbutanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28293 name: (S)-1-aminopropan-2-yl phosphate is_a: CHEBI:19029 ! 1-aminopropan-2-yl phosphate [Term] id: CHEBI:28294 name: dTDP-4-acetamido-4,6-dideoxy-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:28295 name: 2-deoxystreptamine is_a: CHEBI:61689 ! amino cyclitol relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:28296 name: L-alpha-glutamyl phosphate is_a: CHEBI:50163 ! alpha-glutamyl phosphate [Term] id: CHEBI:28297 name: hydantoin-5-propionic acid is_a: CHEBI:24628 ! imidazolidine-2,4-dione is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28300 name: glutamine is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:50331 ! 3-amino-3-oxopropyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:28302 name: glucuronoarabinoxylan is_a: CHEBI:22603 ! arabinoxylans is_a: CHEBI:60938 ! glucuronoxylan [Term] id: CHEBI:28303 name: 2-chlorobenzoate subset: chebi_ph7_3 is_a: CHEBI:23133 ! chlorobenzoate is_a: CHEBI:70856 ! 2-halobenzoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28304 name: heparin subset: chebi_ph7_3 is_a: CHEBI:24505 ! heparins relationship: has_role CHEBI:50249 ! anticoagulant [Term] id: CHEBI:28307 name: precorrin-3A is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:28310 name: 1D-3-O-methyl-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:25270 ! methyl myo-inositols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28311 name: indol-3-ylacetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:22307 ! aldoxime is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:28317 name: 3-aminobutyryl-CoA is_a: CHEBI:22500 ! aminobutanoyl-CoA [Term] id: CHEBI:28318 name: 3,6-dichlorocatechol is_a: CHEBI:23699 ! dichlorocatechol [Term] id: CHEBI:28319 name: L-fucopyranose 1-phosphate is_a: CHEBI:23627 ! deoxyaldohexose phosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28323 name: 3,4-dihydroxycinnamaldehyde subset: chebi_ph7_3 is_a: CHEBI:23245 ! cinnamaldehydes is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28324 name: 11-deoxycortisol subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:23618 ! deoxycortisol is_a: CHEBI:24261 ! glucocorticoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28325 name: (S)-3-hydroxydecanoyl-CoA is_a: CHEBI:86338 ! 3-hydroxydecanoyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28328 name: D-galactosamine is_a: CHEBI:24156 ! galactosamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28330 name: 4-hydroxy-L-threonine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84189 ! L-threonine derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28331 name: erythromycin D is_a: CHEBI:48923 ! erythromycin [Term] id: CHEBI:28339 name: lactose 6'-phosphate is_a: CHEBI:25004 ! lactose phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28340 name: L-2-aminobutyrate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:28343 name: 3-O-alpha-mycarosylerythronolide B subset: chebi_ph7_3 is_a: CHEBI:23955 ! erythronolide [Term] id: CHEBI:28349 name: alpha-L-fucoside subset: chebi_ph7_3 is_a: CHEBI:24119 ! fucoside relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28353 name: 4-hydroxycinnamaldehyde subset: chebi_ph7_3 is_a: CHEBI:23245 ! cinnamaldehydes relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28354 name: 1-deoxy-D-xylulose subset: chebi_ph7_3 is_a: CHEBI:23635 ! deoxypentose relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28358 name: rac-lactic acid is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:42111 ! (R)-lactic acid relationship: has_part CHEBI:422 ! (S)-lactic acid relationship: has_role CHEBI:64049 ! food acidity regulator [Term] id: CHEBI:28359 name: (-)-beta-pinene subset: chebi_ph7_3 is_a: CHEBI:50025 ! beta-pinene [Term] id: CHEBI:28364 name: all-cis-5,8,11,14,17-icosapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:36006 ! icosapentaenoic acid relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite [Term] id: CHEBI:28368 name: novobiocin is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:25698 ! ether is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:33853 ! phenols is_a: CHEBI:35313 ! hexoside is_a: CHEBI:37912 ! hydroxycoumarin is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28375 name: dTDP-3-amino-3,4,6-trideoxy-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:28376 name: 6-acetamido-2-oxohexanoic acid is_a: CHEBI:22160 ! acetamides is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28377 name: plastoquinone-9 subset: chebi_ph7_3 is_a: CHEBI:17757 ! plastoquinone [Term] id: CHEBI:28379 name: (R)-3-methyl-2-oxovaleric acid is_a: CHEBI:35932 ! 3-methyl-2-oxovaleric acid [Term] id: CHEBI:28383 name: alpha,omega-dicarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:28384 name: vitamin K is_a: CHEBI:132142 ! 1,4-naphthoquinones relationship: has_role CHEBI:24020 ! fat-soluble vitamin (role) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28385 name: D-altrose is_a: CHEBI:17608 ! D-aldohexose is_a: CHEBI:37708 ! altrose [Term] id: CHEBI:28386 name: 4-hydroxycinnamyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28390 name: (R)-1-aminopropan-2-yl phosphate is_a: CHEBI:19029 ! 1-aminopropan-2-yl phosphate [Term] id: CHEBI:28393 name: beta-D-glucosamine is_a: CHEBI:47977 ! 2-amino-2-deoxy-D-glucopyranose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28394 name: enol-oxaloacetic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:33823 ! enol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:28395 name: (+-)-trans-acenaphthene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:22156 ! acenaphthenes [Term] id: CHEBI:28396 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:63428 ! digalactosylglycerol derivative is_a: CHEBI:90553 ! 1-dihexosyl-2,3-diacylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28397 name: cis-4-hydroxy-L-proline is_a: CHEBI:20392 ! 4-hydroxyproline is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28398 name: butan-2-one subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:18044 ! dialkyl ketone is_a: CHEBI:22951 ! butanone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28401 name: N-acetyl-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:28000 ! N-acetyl-D-hexosaminide is_a: CHEBI:35373 ! D-glucosaminide is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28408 name: 4-de(dimethylamino)-4-oxoanhydrotetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28412 name: eriodictyol subset: chebi_ph7_3 is_a: CHEBI:38742 ! tetrahydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones [Term] id: CHEBI:28413 name: 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylic acid is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:37292 ! 1-(phosphoribosyl)imidazole is_a: CHEBI:38306 ! imidazole-4-carboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28416 name: 5-hydroxyimidazole-4-acetic acid is_a: CHEBI:88291 ! hydroxyimidazole [Term] id: CHEBI:28417 name: gentamycin C is_a: CHEBI:17833 ! gentamycin [Term] id: CHEBI:28422 name: 3-oxohexanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:28423 name: 6-methoxy-2-octaprenyl-1,4-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones is_a: CHEBI:35795 ! polyprenylbenzoquinone [Term] id: CHEBI:28424 name: alpha-Neu5NAc-(2->8)-alpha-Neu5NAc-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36544 ! sialodiosylceramide relationship: has_part CHEBI:142532 ! alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28425 name: alpha-carotene subset: chebi_ph7_3 is_a: CHEBI:139120 ! carotenoid beta-end derivative is_a: CHEBI:35163 ! cyclic carotene relationship: has_role CHEBI:67200 ! provitamin A relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28426 name: cyanidin 3-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28427 name: arabinoxylan is_a: CHEBI:22603 ! arabinoxylans [Term] id: CHEBI:28428 name: beta-hexachlorocyclohexane subset: chebi_ph7_3 is_a: CHEBI:24536 ! hexachlorocyclohexane is_a: CHEBI:38656 ! organochlorine pesticide relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:28429 name: (+)-dihydromyricetin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:28917 ! dihydromyricetin relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:28433 name: phyllohydroquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:28436 name: delphinidin is_a: CHEBI:140277 ! 5-hydroxyanthocyanidin relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28442 name: 15-oxoprostaglandin F2alpha is_a: CHEBI:36066 ! prostaglandins Falpha [Term] id: CHEBI:28446 name: 3D-3,5/4-trihydroxycyclohexane-1,2-dione subset: chebi_ph7_3 is_a: CHEBI:16145 ! 3,5/4-trihydroxycyclohexane-1,2-dione is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:28453 name: (20S)-20-hydroxypregn-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36728 ! 20-hydroxypregn-4-en-3-one relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28455 name: D-arabinitol 1-phosphate is_a: CHEBI:22295 ! alditol 5-phosphate is_a: CHEBI:22593 ! arabinitol phosphate [Term] id: CHEBI:28459 name: D-alpha-glutamyl phosphate is_a: CHEBI:50163 ! alpha-glutamyl phosphate [Term] id: CHEBI:28460 name: maltotetraose subset: chebi_ph7_3 is_a: CHEBI:61986 ! maltotetraose tetrasaccharide relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28461 name: 4-amino-4-de(dimethylamino)anhydrotetracycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:28462 name: ajmaline is_a: CHEBI:65323 ! monoterpenoid indole alkaloid is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:28464 name: 4-hydroxy-6-methylpretetramide subset: chebi_ph7_3 is_a: CHEBI:25333 ! pretetramide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28465 name: acetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28468 name: 1-O-palmitoyl-sn-glycero-3-phosphocholine is_a: CHEBI:17504 ! 1-O-acyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:28469 name: 4-(hydroxyamino)quinoline N-oxide subset: chebi_ph7_3 is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:36709 ! aminoquinoline [Term] id: CHEBI:28470 name: 3,5-dihydro-4H-imidazol-4-one subset: chebi_ph7_3 is_a: CHEBI:24781 ! imidazolinone [Term] id: CHEBI:28471 name: alpha-D-GalNAc-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36642 ! glycohexaosylceramide [Term] id: CHEBI:28477 name: 7alpha,12alpha-dihydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28478 name: (2-hydroxyphenyl)acetic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28479 name: D-tyrosine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:18186 ! tyrosine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28480 name: aldehydo-L-lyxose subset: chebi_ph7_3 is_a: CHEBI:62320 ! L-lyxose [Term] id: CHEBI:28484 name: isovaleric acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:38653 ! methylbutyric acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28488 name: m-xylene subset: chebi_ph7_3 is_a: CHEBI:27338 ! xylene [Term] id: CHEBI:28490 name: L-methionine sulfoximine is_a: CHEBI:47833 ! methionine sulfoximine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:24319 ! EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor [Term] id: CHEBI:28492 name: 5-methylbarbituric acid is_a: CHEBI:22693 ! barbiturates [Term] id: CHEBI:28493 name: decanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28494 name: cardiolipin is_a: CHEBI:166988 ! glycerophosphoglycerophosphoglycerol is_a: CHEBI:17517 ! phosphatidylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28496 name: N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:28497 name: N-acetyl-beta-D-galactosamine subset: chebi_ph7_3 is_a: CHEBI:28037 ! N-acetyl-D-galactosamine relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:28498 name: acadesine subset: chebi_ph7_3 is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:26556 ! 1-ribosylimidazolecarboxamide is_a: CHEBI:60783 ! nucleoside analogue relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor [Term] id: CHEBI:28499 name: kaempferol is_a: CHEBI:28802 ! flavonols is_a: CHEBI:38684 ! tetrahydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28506 name: arsonoacetic acid is_a: CHEBI:22638 ! organoarsonic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:28507 name: cytidine 2'-phosphate is_a: CHEBI:23523 ! cytidine phosphate is_a: CHEBI:37651 ! pyrimidine ribonucleoside 2'-monophosphate [Term] id: CHEBI:28514 name: N-acetyl-D-glucosaminyl-(1->4)-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysine is_a: CHEBI:17149 ! N-acetyl-beta-D-glycosaminyl glycopeptide [Term] id: CHEBI:28516 name: 1,2-dihydronaphthalene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:90740 ! dihydronaphthalenes relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:28517 name: biphenyl-2,2',3-triol subset: chebi_ph7_3 is_a: CHEBI:24681 ! hydroxybiphenyls is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28518 name: alpha-D-xylose subset: chebi_ph7_3 is_a: CHEBI:53455 ! D-xylopyranose relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:28522 name: 4-hydroxybutyryl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:28526 name: (KDO)2-lipid IVA is_a: CHEBI:25051 ! lipid As relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28528 name: 3-oxodecanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28531 name: cob(I)yrinic acid a,c diamide is_a: CHEBI:48033 ! cobyrinic acid a,c diamide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28533 name: 3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28536 name: 3-hydroxyindolin-2-one subset: chebi_ph7_3 is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:28537 name: all-trans-dehydroretinal subset: chebi_ph7_3 is_a: CHEBI:26534 ! retinals [Term] id: CHEBI:28538 name: N(omega)-hydroxy-L-arginine is_a: CHEBI:24658 ! hydroxy-L-arginine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:28541 name: N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->8)-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine is_a: CHEBI:36544 ! sialodiosylceramide is_a: CHEBI:79215 ! alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28542 name: 2-deoxy-D-ribofuranose 1-phosphate is_a: CHEBI:19564 ! 2-deoxyribose 1-phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:28547 name: D-glucuronate 1-phosphate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28548 name: D-pinitol subset: chebi_ph7_3 is_a: CHEBI:37208 ! pinitol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:23366 ! compatible osmolytes [Term] id: CHEBI:28549 name: 3-(indol-3-yl)-2-oxobutyric acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:28554 name: ajugose subset: chebi_ph7_3 is_a: CHEBI:35368 ! hexasaccharide is_a: CHEBI:74961 ! raffinose family oligosaccharide [Term] id: CHEBI:28556 name: biochanin A 7-O-(6-O-malonyl-beta-D-glucoside) is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:74630 ! glycosyloxyisoflavone [Term] id: CHEBI:28557 name: cyclohexane-1-carbonyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:28558 name: 2,5-dichloro-cis,cis-muconic acid is_a: CHEBI:38421 ! 2,5-dichloromuconic acid [Term] id: CHEBI:28563 name: beta-D-mannose subset: chebi_ph7_3 is_a: CHEBI:4208 ! D-mannopyranose relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:28573 name: (R)-3-hydroxyoctanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:28578 name: 2-hydroxyglutaryl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:28579 name: epsilon-caprolactam subset: chebi_ph7_3 is_a: CHEBI:23000 ! caprolactams relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28581 name: UDP-N-acetyl-D-mannosaminouronic acid is_a: CHEBI:22119 ! UDP-N-acetylmannosaminouronic acid [Term] id: CHEBI:28585 name: 4-carboxy-4'-sulfoazobenzene is_a: CHEBI:22682 ! azobenzenes is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26825 ! sulfobenzoic acid [Term] id: CHEBI:28586 name: verbascose subset: chebi_ph7_3 is_a: CHEBI:35369 ! pentasaccharide is_a: CHEBI:74961 ! raffinose family oligosaccharide [Term] id: CHEBI:28587 name: D-threose subset: chebi_ph7_3 is_a: CHEBI:33947 ! threose [Term] id: CHEBI:28591 name: guaiacol subset: chebi_ph7_3 is_a: CHEBI:134251 ! guaiacols relationship: has_role CHEBI:48219 ! disinfectant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77035 ! expectorant relationship: has_role CHEBI:77484 ! EC 1.1.1.25 (shikimate dehydrogenase) inhibitor [Term] id: CHEBI:28592 name: ricinoleic acid is_a: CHEBI:85639 ! (9Z)-12-hydroxyoctadec-9-enoic acid [Term] id: CHEBI:28599 name: siroheme is_a: CHEBI:30413 ! heme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28600 name: farnesol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26199 ! polyprenol is_a: CHEBI:36757 ! farnesane sesquiterpenoid relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:28602 name: beta-D-fructofuranose 2,6-bisphosphate is_a: CHEBI:78687 ! D-fructofuranose 2,6-bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28607 name: coproporphyrinogen I is_a: CHEBI:15438 ! coproporphyrinogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28609 name: N-benzoyl-4-methoxyanthranilic acid is_a: CHEBI:22702 ! benzamides is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:28610 name: 1-O-oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:131739 ! lysophosphatidylcholine (18:1/0:0) is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:76083 ! oleoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:28616 name: carbamic acid is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:35605 ! carbon oxoacid is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28618 name: 1,4-dichlorobenzene subset: chebi_ph7_3 is_a: CHEBI:23697 ! dichlorobenzene relationship: has_role CHEBI:24852 ! insecticide [Term] id: CHEBI:28619 name: acrylamide subset: chebi_ph7_3 is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:22216 ! acrylamides is_a: CHEBI:83628 ! N-acylammonia relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:77523 ! Maillard reaction product [Term] id: CHEBI:28624 name: tetrahydrofolyl-poly(glutamic acid) macromolecule is_a: CHEBI:26908 ! tetrahydrofolyl glutamate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28629 name: precorrin-8X is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:28630 name: 3-hydroxypyridin-4(1H)-one subset: chebi_ph7_3 is_a: CHEBI:20485 ! 4-pyridones [Term] id: CHEBI:28631 name: 3-phenylpropionic acid is_a: CHEBI:22712 ! benzenes is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28632 name: (S)-3-hydroxyoctanoyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28635 name: 2-isopropylmalic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28636 name: 3-methyl-6-methoxy-2-octaprenyl-1,4-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:35795 ! polyprenylbenzoquinone [Term] id: CHEBI:28637 name: 2',3'-cyclic UMP is_a: CHEBI:19218 ! 2',3'-cyclic pyrimidine nucleotide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28638 name: isobutyronitrile subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:80291 ! aliphatic nitrile relationship: has_role CHEBI:48358 ! polar aprotic solvent [Term] id: CHEBI:28639 name: UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioic acid is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:28640 name: lipoteichoic acid is_a: CHEBI:30049 ! teichoic acid [Term] id: CHEBI:28644 name: 2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:25798 ! oxopentanoates is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:28645 name: beta-D-fructofuranose subset: chebi_ph7_3 is_a: CHEBI:37721 ! D-fructofuranose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28646 name: ammeline subset: chebi_ph7_3 is_a: CHEBI:38170 ! diamino-1,3,5-triazine is_a: CHEBI:38172 ! monohydroxy-1,3,5-triazine [Term] id: CHEBI:28647 name: 3-O-methylgallic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:28648 name: beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36541 ! sialotriaosylceramide is_a: CHEBI:79219 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide relationship: has_part CHEBI:142522 ! beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-R group relationship: has_part CHEBI:142532 ! alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp-yl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28651 name: (S)-norlaudanosoline is_a: CHEBI:28770 ! norlaudanosoline [Term] id: CHEBI:28654 name: 3-methyl-2-oxovalerate subset: chebi_ph7_3 is_a: CHEBI:191201 ! branched-chain keto acid anion is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28659 name: phosphorus atom subset: chebi_ph7_3 is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33300 ! pnictogen relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:28660 name: (-)-alpha-pinene subset: chebi_ph7_3 is_a: CHEBI:36740 ! alpha-pinene [Term] id: CHEBI:28661 name: gamma-linolenic acid is_a: CHEBI:25048 ! linolenic acid is_a: CHEBI:36009 ! omega-6 fatty acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28663 name: galactitol 1-phosphate is_a: CHEBI:22292 ! alditol 1-phosphate is_a: CHEBI:24582 ! hexitol phosphate is_a: CHEBI:63432 ! galactitol derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28666 name: leukotriene D4 is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:50141 ! bronchoconstrictor agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28667 name: 11-dehydro-thromboxane B2 is_a: CHEBI:26995 ! thromboxane relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28669 name: bacitracin is_a: CHEBI:60004 ! mixture relationship: has_part CHEBI:35862 ! bacitracin A relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:28673 name: 3-oxopropanoyl-CoA is_a: CHEBI:26296 ! propanoyl-CoAs [Term] id: CHEBI:28675 name: dextrin is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:28680 name: cytarabine subset: chebi_ph7_3 is_a: CHEBI:26440 ! pyrimidine nucleoside is_a: CHEBI:38315 ! beta-D-arabinoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35705 ! immunosuppressive agent [Term] id: CHEBI:28681 name: N,N'-diacetylchitobiose subset: chebi_ph7_3 is_a: CHEBI:23101 ! N,N'-diacetylchitobioses relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28683 name: kynurenine is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28684 name: 4-acetamidobutanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:28685 name: molybdenum atom subset: chebi_ph7_3 is_a: CHEBI:33350 ! chromium group element atom relationship: has_role CHEBI:27027 ! micronutrient [Term] id: CHEBI:28689 name: dehydroepiandrosterone subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28691 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:90803 ! alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28694 name: copper atom subset: chebi_ph7_3 is_a: CHEBI:33366 ! copper group element atom is_a: CHEBI:88184 ! metal allergen relationship: has_role CHEBI:27027 ! micronutrient relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28697 name: 21-deoxycortisol subset: chebi_ph7_3 is_a: CHEBI:138141 ! 17alpha-hydroxy-C21-steroid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:23618 ! deoxycortisol is_a: CHEBI:35346 ! 11beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28699 name: cyclic 2,3-bisphospho-D-glyceric acid is_a: CHEBI:22902 ! bisphosphoglyceric acid [Term] id: CHEBI:28700 name: 20-hydroxy-leukotriene E4 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:28701 name: chenodeoxycholoyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28706 name: trans-hex-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28708 name: 3-isopropylcatechol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:28710 name: 3-hydroxy-3-methyl-2-oxopentanoic acid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:28715 name: 5-hydroxykynurenamine is_a: CHEBI:24705 ! hydroxykynurenamine is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28716 name: palmitoleic acid is_a: CHEBI:72004 ! hexadec-9-enoic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite relationship: has_role CHEBI:84735 ! algal metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28717 name: O-decanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:68830 ! O-decanoylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28718 name: L-allothreonine is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:38262 ! allothreonine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28719 name: 4-hydroxyphenylglyoxylic acid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:28721 name: ribulose is_a: CHEBI:24977 ! ketopentose [Term] id: CHEBI:28723 name: D-glycero-D-manno-heptose 7-phosphate is_a: CHEBI:35157 ! aldoheptose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28724 name: 9,10-dihydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:28725 name: N(6')-acetylkanamycin is_a: CHEBI:22201 ! acetylkanamycin [Term] id: CHEBI:28726 name: 3-oxotetradecanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28727 name: trans-vaccenic acid is_a: CHEBI:36023 ! vaccenic acid [Term] id: CHEBI:28728 name: thromboxane B2 is_a: CHEBI:26996 ! thromboxanes B relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28729 name: alpha-D-mannose subset: chebi_ph7_3 is_a: CHEBI:4208 ! D-mannopyranose relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:28731 name: gibberellin A19 is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28733 name: 1-linoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:140444 ! linoleoyl-sn-glycero-3-phosphocholine is_a: CHEBI:91309 ! lysophosphatidylcholine(18:2/0:0) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28737 name: digalacturonate is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:33812 ! galacturonates [Term] id: CHEBI:28743 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:90802 ! alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28744 name: 2-hydroxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36857 ! 2-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28745 name: L-xylo-hex-3-ulonolactone subset: chebi_ph7_3 is_a: CHEBI:37427 ! ketoaldonolactone [Term] id: CHEBI:28747 name: picolinic acid is_a: CHEBI:26420 ! pyridinemonocarboxylic acid relationship: has_role CHEBI:64345 ! MALDI matrix material relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28748 name: doxorubicin is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28749 name: aryl beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:28750 name: 17alpha-hydroxypregnenolone subset: chebi_ph7_3 is_a: CHEBI:138141 ! 17alpha-hydroxy-C21-steroid is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36730 ! hydroxypregnenolone relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28751 name: biochanin A 7-O-beta-D-glucoside is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:140301 ! 7-hydroxyisoflavones 7-O-beta-D-glucoside is_a: CHEBI:38755 ! hydroxyisoflavone relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:28755 name: 2,4,6-trichlorophenol is_a: CHEBI:27102 ! trichlorophenol relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:28757 name: fructose is_a: CHEBI:24973 ! ketohexose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:28759 name: 3-oxo-3-phenylpropionic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:28761 name: N-acetyl-D-galactosaminide subset: chebi_ph7_3 is_a: CHEBI:20954 ! D-galactosaminide is_a: CHEBI:28000 ! N-acetyl-D-hexosaminide is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:28763 name: 4,4'-dichlorodiphenylmethane subset: chebi_ph7_3 is_a: CHEBI:23156 ! chlorophenylmethane is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:28765 name: phosphatidylinositol phosphate is_a: CHEBI:18179 ! phosphoinositide [Term] id: CHEBI:28766 name: uroporphyrinogen I is_a: CHEBI:27258 ! uroporphyrinogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28767 name: 2-deoxy-D-ribose 1,5-bisphosphate is_a: CHEBI:19568 ! 2-deoxyribose bisphosphate [Term] id: CHEBI:28768 name: p-cymene subset: chebi_ph7_3 is_a: CHEBI:27024 ! toluenes is_a: CHEBI:35187 ! monoterpene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:28770 name: norlaudanosoline is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:24923 ! isoquinolinol is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28774 name: 3,3',5'-triiodothyronine is_a: CHEBI:24864 ! iodothyronine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28775 name: hesperidin subset: chebi_ph7_3 is_a: CHEBI:140332 ! 4'-methoxyflavanones is_a: CHEBI:26587 ! rutinoside is_a: CHEBI:38738 ! monomethoxyflavanone is_a: CHEBI:38749 ! dihydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:72730 ! flavanone glycoside relationship: has_role CHEBI:25435 ! mutagen [Term] id: CHEBI:28777 name: liquiritigenin subset: chebi_ph7_3 is_a: CHEBI:136678 ! 4',7-dihydroxyflavanone relationship: has_role CHEBI:51060 ! hormone agonist relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28785 name: (+)-ureidoglycolic acid is_a: CHEBI:49050 ! ureidoglycolic acid [Term] id: CHEBI:28787 name: nitroglycerin subset: chebi_ph7_3 is_a: CHEBI:25560 ! nitroglycerol relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50566 ! nitric oxide donor relationship: has_role CHEBI:51371 ! muscle relaxant relationship: has_role CHEBI:63490 ! explosive relationship: has_role CHEBI:66993 ! tocolytic agent [Term] id: CHEBI:28788 name: quinoline-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:26507 ! dihydroxyquinoline [Term] id: CHEBI:28789 name: L-glucitol subset: chebi_ph7_3 is_a: CHEBI:30911 ! glucitol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:28790 name: serotonin is_a: CHEBI:25375 ! monoamine molecular messenger is_a: CHEBI:27162 ! tryptamines is_a: CHEBI:33853 ! phenols is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28791 name: isoglutamic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:28792 name: erucic acid is_a: CHEBI:36031 ! docosenoic acid [Term] id: CHEBI:28793 name: beta-D-glucan is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:28794 name: coumarin subset: chebi_ph7_3 is_a: CHEBI:23403 ! coumarins relationship: has_role CHEBI:51121 ! fluorescent dye relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28796 name: fructan is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:28797 name: D-alpha-aminobutyric acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:35621 ! alpha-aminobutyric acid [Term] id: CHEBI:28800 name: N-acetylgalactosamine is_a: CHEBI:21655 ! N-acylgalactosamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28802 name: flavonols subset: chebi_ph7_3 is_a: CHEBI:192499 ! anthoxanthin is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:28803 name: pyridoxine 5'-phosphate is_a: CHEBI:36970 ! vitamin B6 phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28804 name: D-2-aminopentanoic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:19475 ! 2-aminopentanoic acid relationship: has_role CHEBI:77953 ! EC 6.1.1.4 (leucine--tRNA ligase) inhibitor [Term] id: CHEBI:28806 name: 2'-deoxyinosine-5'-monophosphate is_a: CHEBI:23630 ! deoxyinosine phosphate is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28807 name: dITP is_a: CHEBI:23630 ! deoxyinosine phosphate is_a: CHEBI:37042 ! purine 2'-deoxyribonucleoside 5'-triphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28808 name: mannan is_a: CHEBI:37164 ! homopolysaccharide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:28812 name: (aminomethyl)phosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:28813 name: sinapyl alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:51681 ! dimethoxybenzene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28815 name: heparan sulfate is_a: CHEBI:35721 ! heparan sulfates relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28817 name: dodecane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28818 name: (24R)-24,25-dihydroxycalciol subset: chebi_ph7_3 is_a: CHEBI:36818 ! seco-cholestane is_a: CHEBI:36853 ! hydroxy seco-steroid is_a: CHEBI:47042 ! hydroxycalciol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28821 name: piperine subset: chebi_ph7_3 is_a: CHEBI:140326 ! tertiary carboxamide is_a: CHEBI:26147 ! piperidine alkaloid is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:48591 ! N-acylpiperidine relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28822 name: icosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28823 name: 2'-deoxyinosine-5'-diphosphate is_a: CHEBI:23630 ! deoxyinosine phosphate is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28824 name: stigmasterol subset: chebi_ph7_3 is_a: CHEBI:131703 ! stigmastane sterol is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28826 name: fluoromethane subset: chebi_ph7_3 is_a: CHEBI:25253 ! methyl halides is_a: CHEBI:39281 ! fluoromethanes is_a: CHEBI:46695 ! fluorohydrocarbon relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:28827 name: sparteine is_a: CHEBI:26515 ! quinolizidine alkaloid is_a: CHEBI:38526 ! quinolizidine alkaloid fundamental parent [Term] id: CHEBI:28829 name: aminophenol is_a: CHEBI:33853 ! phenols is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:28831 name: propan-1-ol subset: chebi_ph7_3 is_a: CHEBI:157770 ! short-chain primary fatty alcohol is_a: CHEBI:26279 ! propan-1-ols relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:28833 name: gibberellin A3 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28834 name: deoxycholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28835 name: testosterone 17-glucosiduronic acid is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28837 name: octanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28838 name: lutein subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77182 ! food colouring [Term] id: CHEBI:28839 name: 3-disulfanyl-L-alanine is_a: CHEBI:47910 ! S-substituted L-cysteine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28842 name: octadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26607 ! saturated fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:28843 name: 5-amino-1-(5-phospho-D-ribosyl)imidazole is_a: CHEBI:22512 ! aminoimidazole is_a: CHEBI:37292 ! 1-(phosphoribosyl)imidazole [Term] id: CHEBI:28846 name: dCDP is_a: CHEBI:37037 ! pyrimidine 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:37092 ! 2'-deoxycytidine phosphate relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28847 name: D-fucose is_a: CHEBI:33984 ! fucose [Term] id: CHEBI:28850 name: dUDP is_a: CHEBI:23641 ! deoxyuridine phosphate is_a: CHEBI:37037 ! pyrimidine 2'-deoxyribonucleoside 5'-diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28851 name: phenanthrene subset: chebi_ph7_3 is_a: CHEBI:25961 ! phenanthrenes is_a: CHEBI:35296 ! ortho-fused polycyclic arene is_a: CHEBI:37089 ! ortho-fused tricyclic hydrocarbon relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:28852 name: prostaglandin F1alpha is_a: CHEBI:36066 ! prostaglandins Falpha relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28853 name: isopimpinellin subset: chebi_ph7_3 is_a: CHEBI:26369 ! psoralens [Term] id: CHEBI:28854 name: 2,4-D is_a: CHEBI:23152 ! chlorophenoxyacetic acid is_a: CHEBI:23697 ! dichlorobenzene relationship: has_role CHEBI:23582 ! defoliant relationship: has_role CHEBI:26841 ! synthetic auxin relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:60575 ! phenoxy herbicide relationship: has_role CHEBI:77484 ! EC 1.1.1.25 (shikimate dehydrogenase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:28855 name: enterobactin is_a: CHEBI:145559 ! macrotriolide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33566 ! catechols is_a: CHEBI:37409 ! crown compound relationship: has_role CHEBI:26672 ! siderophore relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28856 name: p-toluate subset: chebi_ph7_3 is_a: CHEBI:27021 ! toluate [Term] id: CHEBI:28857 name: (Z)-hex-3-en-1-ol subset: chebi_ph7_3 is_a: CHEBI:145715 ! hex-3-en-1-ol relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28858 name: 1D-myo-inositol 3,4-bisphosphate is_a: CHEBI:25443 ! myo-inositol bisphosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28859 name: 5alpha-androstane subset: chebi_ph7_3 is_a: CHEBI:35509 ! androstane relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28860 name: beta-D-glucuronic acid is_a: CHEBI:47952 ! D-glucopyranuronic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:28861 name: gibberellin A8 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28862 name: dGDP is_a: CHEBI:23625 ! deoxyguanosine phosphate is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:63573 ! guanyl deoxyribonucleotide relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:28863 name: flavanones subset: chebi_ph7_3 is_a: CHEBI:38672 ! flavans is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:28864 name: tobramycin is_a: CHEBI:22479 ! amino cyclitol glycoside relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:28865 name: taurocholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate is_a: CHEBI:37793 ! amino sulfonic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28866 name: tetracosanoic acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83146 ! Daphnia tenebrosa metabolite [Term] id: CHEBI:28867 name: O-propanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35842 ! antirheumatic drug relationship: has_role CHEBI:38147 ! cardiotonic drug relationship: has_role CHEBI:49110 ! peripheral nervous system drug relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28868 name: fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:18059 ! lipid is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:28869 name: menadione subset: chebi_ph7_3 is_a: CHEBI:132142 ! 1,4-naphthoquinones is_a: CHEBI:28384 ! vitamin K relationship: has_role CHEBI:147285 ! EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:28870 name: 1-O-all-trans-retinoyl-beta-glucuronic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:33886 ! glucuronic acids relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28873 name: cis-2-coumaric acid is_a: CHEBI:18176 ! 2-coumaric acid [Term] id: CHEBI:28874 name: phosphatidylinositol is_a: CHEBI:36315 ! glycerophosphoinositol [Term] id: CHEBI:28875 name: tetradecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78444 ! EC 3.1.1.1 (carboxylesterase) inhibitor relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:28878 name: dodecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23866 ! dodecanol relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:64857 ! cosmetic relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28879 name: 9-O-acetylneuraminic acid is_a: CHEBI:25508 ! neuraminic acids is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:28880 name: (S)-mevalonic acid is_a: CHEBI:194519 ! 3,5-dihydroxy-3-methylpentanoic acid [Term] id: CHEBI:28881 name: 2-acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:47978 ! N-acetylmuramate [Term] id: CHEBI:28884 name: N-phenylacetamide subset: chebi_ph7_3 is_a: CHEBI:13248 ! anilide is_a: CHEBI:22160 ! acetamides relationship: has_role CHEBI:35480 ! analgesic [Term] id: CHEBI:28885 name: butan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:157770 ! short-chain primary fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28887 name: dimethyl ether subset: chebi_ph7_3 is_a: CHEBI:25698 ! ether [Term] id: CHEBI:28889 name: 5,6,7,8-tetrahydropteridine subset: chebi_ph7_3 is_a: CHEBI:26373 ! pteridines relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28890 name: coenzyme B is_a: CHEBI:84189 ! L-threonine derivative relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:28891 name: oxanthrene subset: chebi_ph7_3 is_a: CHEBI:23825 ! dibenzodioxine is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:36680 ! heteranthrene is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38180 ! polycyclic heteroarene [Term] id: CHEBI:28892 name: ganglioside is_a: CHEBI:17761 ! ceramide is_a: CHEBI:36526 ! acidic glycosphingolipid [Term] id: CHEBI:28894 name: 1-O-alkyl-2-O-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:28895 name: 3'-UMP is_a: CHEBI:27237 ! uridine phosphate is_a: CHEBI:37018 ! pyrimidine ribonucleoside 3'-monophosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28897 name: pentadecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28898 name: P(1),P(5)-bis(5'-adenosyl) pentaphosphate is_a: CHEBI:63737 ! diadenosyl pentaphosphate relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28900 name: N-alkylphthalic monoamide is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:28902 name: N-phenylhydroxylamine subset: chebi_ph7_3 is_a: CHEBI:35323 ! N-substituted amine [Term] id: CHEBI:28903 name: decan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:195598 ! decanol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:28905 name: prop-2-yn-1-ol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:26313 ! propynol is_a: CHEBI:73477 ! terminal acetylenic compound relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:28907 name: 2,3-bisphosphoglyceric acid is_a: CHEBI:22902 ! bisphosphoglyceric acid is_a: CHEBI:63455 ! tetronic acid derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28909 name: iprodione subset: chebi_ph7_3 is_a: CHEBI:22712 ! benzenes is_a: CHEBI:24628 ! imidazolidine-2,4-dione is_a: CHEBI:47857 ! ureas is_a: CHEBI:87068 ! imidazole fungicide is_a: CHEBI:87197 ! dichlorophenyl dicarboximide fungicide relationship: has_role CHEBI:25491 ! nematicide relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:28911 name: cob(III)alamin subset: chebi_ph7_3 is_a: CHEBI:30411 ! cobalamin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28913 name: (2E)-hexenal subset: chebi_ph7_3 is_a: CHEBI:19591 ! 2-hexenal relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28914 name: 1-acyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:16617 ! 1-acylglycerophosphoinositol [Term] id: CHEBI:28915 name: fosfomycin is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:78379 ! EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor [Term] id: CHEBI:28917 name: dihydromyricetin subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:192500 ! flavanonol is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:38744 ! hexahydroxyflavanone is_a: CHEBI:48025 ! 3',5'-dihydroxyflavanone is_a: CHEBI:48039 ! dihydroflavonols [Term] id: CHEBI:28918 name: (R)-adrenaline is_a: CHEBI:194548 ! 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol relationship: has_role CHEBI:24621 ! hormone relationship: has_role CHEBI:35522 ! beta-adrenergic agonist relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35569 ! alpha-adrenergic agonist relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:37886 ! adrenergic agonist relationship: has_role CHEBI:50513 ! mydriatic agent relationship: has_role CHEBI:50514 ! vasoconstrictor agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28919 name: estrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28927 name: sakuranetin subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:38738 ! monomethoxyflavanone is_a: CHEBI:38749 ! dihydroxyflavanone is_a: CHEBI:60951 ! flavonoid phytoalexin relationship: has_role CHEBI:64912 ! antimycobacterial drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28928 name: angelicin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:28931 name: 3'-AMP is_a: CHEBI:37020 ! purine ribonucleoside 3'-monophosphate is_a: CHEBI:37097 ! adenosine 3'-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28934 name: vitamin D2 subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D is_a: CHEBI:36819 ! seco-ergostane is_a: CHEBI:36853 ! hydroxy seco-steroid relationship: has_role CHEBI:33288 ! rodenticide relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28935 name: (E)-hexadec-2-enoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:52381 ! hexadec-2-enoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28936 name: 2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28937 name: (-)-abscisic acid is_a: CHEBI:22152 ! 2-cis-abscisic acid relationship: has_role CHEBI:37848 ! plant hormone [Term] id: CHEBI:28938 name: ammonium subset: chebi_ph7_3 is_a: CHEBI:35106 ! nitrogen hydride is_a: CHEBI:50313 ! onium cation is_a: CHEBI:60242 ! monovalent inorganic cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28939 name: N-acetyl-L-cysteine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:22198 ! acetylcysteine is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:36044 ! antiviral drug relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:74529 ! antidote to paracetamol poisoning relationship: has_role CHEBI:77034 ! mucolytic relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28940 name: calciol subset: chebi_ph7_3 is_a: CHEBI:26764 ! steroid hormone is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36818 ! seco-cholestane is_a: CHEBI:36853 ! hydroxy seco-steroid is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28941 name: docosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28942 name: CDP-alpha-D-glucose is_a: CHEBI:35242 ! CDP-D-glucose [Term] id: CHEBI:28943 name: N-acylsphingosine 1-phosphoethanolamine is_a: CHEBI:73204 ! ceramide phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28944 name: N-acetyl-7-O-acetylneuraminate subset: chebi_ph7_3 is_a: CHEBI:29065 ! N-acetyl-O-acetylneuraminate [Term] id: CHEBI:28946 name: theobromine subset: chebi_ph7_3 is_a: CHEBI:23818 ! dimethylxanthine relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:71232 ! adenosine receptor antagonist relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:28947 name: (5-oxo-2-sulfo-2,5-dihydrofuran-2-yl)acetic acid is_a: CHEBI:23730 ! 5-oxo-2-furylacetic acid is_a: CHEBI:33551 ! organosulfonic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28948 name: gramine is_a: CHEBI:38631 ! aminoalkylindole is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28951 name: (9S,10S)-9,10-dihydrophenanthrene-9,10-diol subset: chebi_ph7_3 is_a: CHEBI:37470 ! trans-9,10-dihydrophenanthrene-9,10-diol [Term] id: CHEBI:28952 name: 5alpha-pregnane-3,20-dione subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:64600 ! C21-steroid hormone relationship: has_role CHEBI:50745 ! progestogen relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28955 name: 2-methoxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50926 ! angiogenesis modulating agent relationship: has_role CHEBI:64911 ! antimitotic relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28956 name: cobinamide subset: chebi_ph7_3 is_a: CHEBI:23390 ! cobalt-corrinoid hexaamide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:28963 name: amino sugar is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:28965 name: dicarboxylic acid dianion subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:38716 ! carboxylic acid dianion [Term] id: CHEBI:28966 name: chlorophyll is_a: CHEBI:25111 ! magnesium porphyrin [Term] id: CHEBI:28968 name: N'-phosphoguanidinoethyl methyl hydrogen phosphate is_a: CHEBI:24442 ! guanidinoethyl methyl phosphates [Term] id: CHEBI:28969 name: N,N-dimethyltryptamine is_a: CHEBI:27162 ! tryptamines is_a: CHEBI:48274 ! tryptamine alkaloid [Term] id: CHEBI:28970 name: biphenyl-2,2'-diol subset: chebi_ph7_3 is_a: CHEBI:24681 ! hydroxybiphenyls [Term] id: CHEBI:28972 name: (R)-propane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:16997 ! propane-1,2-diol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28975 name: 2,5-dichloro-2,5-cyclohexadiene-1,4-diol subset: chebi_ph7_3 is_a: CHEBI:23469 ! cyclohexadienediol is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:28976 name: carbonic acid is_a: CHEBI:35605 ! carbon oxoacid is_a: CHEBI:36961 ! chalcocarbonic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:28977 name: 2-hydroxy-3-carboxylato-6-oxo-7-methylocta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:28982 name: (S)-1,2-epoxypropane subset: chebi_ph7_3 is_a: CHEBI:38685 ! 1,2-epoxypropane [Term] id: CHEBI:28984 name: aluminium atom subset: chebi_ph7_3 is_a: CHEBI:33317 ! boron group element atom is_a: CHEBI:33521 ! metal atom [Term] id: CHEBI:28985 name: (R)-1,2-epoxypropane subset: chebi_ph7_3 is_a: CHEBI:38685 ! 1,2-epoxypropane [Term] id: CHEBI:28987 name: abietic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36762 ! abietane diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:28989 name: 2,4,5-trichlorocyclohexa-2,5-dien-1-ol subset: chebi_ph7_3 is_a: CHEBI:23470 ! cyclohexadienol is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:28990 name: 2-hydroxy-6-(2-hydroxyphenoxy)-6-oxo-cis,cis-hexa-2,4-dienoic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:28991 name: (2S,3R)-aldono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:140380 ! an aldono-1,5-lactone is_a: CHEBI:74105 ! aldono-1,5-lactone [Term] id: CHEBI:28992 name: 2-hydroxychromene-2-carboxylic acid is_a: CHEBI:39436 ! chromenol is_a: CHEBI:59352 ! chromenemonocarboxylic acid [Term] id: CHEBI:28995 name: 2,4-dichlorobenzoate subset: chebi_ph7_3 is_a: CHEBI:23133 ! chlorobenzoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:28997 name: 2'-deoxyinosine subset: chebi_ph7_3 is_a: CHEBI:142361 ! purines 2'-deoxy-D-ribonucleoside is_a: CHEBI:19254 ! purine 2'-deoxyribonucleoside relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:28999 name: N-acetyl-9-O-acetylneuraminate subset: chebi_ph7_3 is_a: CHEBI:29065 ! N-acetyl-O-acetylneuraminate [Term] id: CHEBI:29001 name: (3R)-3-isopropenyl-6-oxoheptanoate subset: chebi_ph7_3 is_a: CHEBI:64234 ! 3-isopropenyl-6-oxoheptanoate [Term] id: CHEBI:29002 name: (S)-propane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:16997 ! propane-1,2-diol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29003 name: L-citramalic acid is_a: CHEBI:15584 ! citramalic acid [Term] id: CHEBI:29005 name: cyclohexane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:23453 ! cycloalkane relationship: has_role CHEBI:48355 ! non-polar solvent [Term] id: CHEBI:29006 name: N-acetyl-4-O-acetylneuraminate subset: chebi_ph7_3 is_a: CHEBI:29065 ! N-acetyl-O-acetylneuraminate [Term] id: CHEBI:29009 name: N(tele)-methylhistamine is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29010 name: 2'-aminobiphenyl-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:22496 ! aminobiphenyl relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:29013 name: fusidic acid is_a: CHEBI:19129 ! 11alpha-hydroxy steroid is_a: CHEBI:26761 ! steroid antibiotic is_a: CHEBI:35915 ! sterol ester is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77194 ! EC 2.7.1.33 (pantothenate kinase) inhibitor [Term] id: CHEBI:29014 name: cordycepin subset: chebi_ph7_3 is_a: CHEBI:22260 ! adenosines is_a: CHEBI:36987 ! 3'-deoxyribonucleoside relationship: has_role CHEBI:25605 ! nucleoside antibiotic relationship: has_role CHEBI:35221 ! antimetabolite [Term] id: CHEBI:29016 name: arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:26167 ! polar amino acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:50340 ! 3-carbamimidamidopropyl group relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29017 name: 1-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:55493 ! 1-O-acylglycerophosphoethanolamine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29019 name: nonanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:22583 ! antifeedant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:29021 name: hexane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:29024 name: 4-methyl-3-oxopentanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid [Term] id: CHEBI:29028 name: glucobrassicin is_a: CHEBI:24821 ! indolyl carbohydrate is_a: CHEBI:79364 ! indolylmethylglucosinolic acid [Term] id: CHEBI:29031 name: phosphinic acid is_a: CHEBI:26044 ! phosphinic acids is_a: CHEBI:33457 ! phosphorus oxoacid relationship: has_role CHEBI:22586 ! antioxidant [Term] id: CHEBI:29032 name: (R)-pantothenate subset: chebi_ph7_3 is_a: CHEBI:16454 ! pantothenate is_a: CHEBI:176840 ! vitamin B5 relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29033 name: iron(2+) subset: chebi_ph7_3 is_a: CHEBI:24875 ! iron cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29034 name: iron(3+) subset: chebi_ph7_3 is_a: CHEBI:24875 ! iron cation is_a: CHEBI:27153 ! monoatomic trication relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29035 name: manganese(2+) subset: chebi_ph7_3 is_a: CHEBI:25155 ! manganese cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:29036 name: copper(2+) subset: chebi_ph7_3 is_a: CHEBI:23378 ! copper cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:29039 name: 1,2-diacyl-sn-glycero-3-phospho-1'-(3'-O-L-lysyl)-sn-glycerol is_a: CHEBI:17517 ! phosphatidylglycerol is_a: CHEBI:25095 ! L-lysine derivative [Term] id: CHEBI:29041 name: manganese(3+) subset: chebi_ph7_3 is_a: CHEBI:25155 ! manganese cation is_a: CHEBI:27153 ! monoatomic trication [Term] id: CHEBI:29042 name: alpha-D-glucose 1-phosphate is_a: CHEBI:16077 ! D-glucopyranose 1-phosphate [Term] id: CHEBI:29043 name: O-beta-D-glucosyl-cis-zeatin subset: chebi_ph7_3 is_a: CHEBI:38646 ! O-beta-D-glucosylzeatin [Term] id: CHEBI:29044 name: 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:36147 ! oxo dicarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:29045 name: maleamic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:29051 name: D-mannosyl undecaprenyl phosphate is_a: CHEBI:21060 ! mannose phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:29052 name: D-glyceraldehyde 3-phosphate is_a: CHEBI:17138 ! glyceraldehyde 3-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:29053 name: pyridine-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:23793 ! dihydroxypyridine [Term] id: CHEBI:29055 name: 3,4-dihydroxyphenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:29056 name: lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:29057 name: keratan is_a: CHEBI:18085 ! glycosaminoglycan [Term] id: CHEBI:29060 name: alpha-pinene oxide subset: chebi_ph7_3 is_a: CHEBI:26133 ! pinane monoterpenoid is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29062 name: GDP-glucose is_a: CHEBI:21167 ! GDP-hexose relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29063 name: L-mimosine is_a: CHEBI:20485 ! 4-pyridones is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29064 name: 1,6,6-trimethyl-2,7-dioxabicyclo[3.2.2]nonan-3-one subset: chebi_ph7_3 is_a: CHEBI:25579 ! nonanone [Term] id: CHEBI:29065 name: N-acetyl-O-acetylneuraminate is_a: CHEBI:21619 ! N-acetylneuraminates [Term] id: CHEBI:29067 name: carboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:29069 name: phthalic acid is_a: CHEBI:26094 ! benzenedicarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:29071 name: 3-deoxy-D-glycero-hexo-2,5-diulosonate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:29073 name: L-ascorbic acid is_a: CHEBI:176783 ! vitamin C is_a: CHEBI:22652 ! ascorbic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:64577 ! flour treatment agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77962 ! food antioxidant relationship: has_role CHEBI:85046 ! skin lightening agent [Term] id: CHEBI:29074 name: dolichyl palmitate subset: chebi_ph7_3 is_a: CHEBI:16030 ! acyldolichol is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:29075 name: mononucleotide is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:29076 name: 3''-adenylylstreptomycin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24436 ! guanidines is_a: CHEBI:26787 ! streptomycin phosphate is_a: CHEBI:35244 ! nucleotide-oligosaccharide is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:29081 name: synephrine is_a: CHEBI:23981 ! ethanolamines is_a: CHEBI:33853 ! phenols is_a: CHEBI:38605 ! phenethylamine alkaloid relationship: has_role CHEBI:35569 ! alpha-adrenergic agonist relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29083 name: N-methyl-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:29084 name: (2->1)-beta-D-fructan subset: chebi_ph7_3 is_a: CHEBI:28796 ! fructan [Term] id: CHEBI:29086 name: 3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oic acid is_a: CHEBI:26616 ! seco-androstane is_a: CHEBI:33823 ! enol is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:29089 name: 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:16337 ! phosphatidic acid is_a: CHEBI:26706 ! sn-glycerol 3-phosphates [Term] id: CHEBI:29090 name: D-2-aminohexano-6-lactam is_a: CHEBI:19471 ! 2-aminohexano-6-lactam [Term] id: CHEBI:29091 name: nocardicin E is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25572 ! nocardicin [Term] id: CHEBI:29094 name: homoisocitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:29101 name: sodium(1+) subset: chebi_ph7_3 is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:33504 ! alkali metal cation is_a: CHEBI:37246 ! elemental sodium is_a: CHEBI:60242 ! monovalent inorganic cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29103 name: potassium(1+) subset: chebi_ph7_3 is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:33504 ! alkali metal cation is_a: CHEBI:37247 ! elemental potassium is_a: CHEBI:60242 ! monovalent inorganic cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29105 name: zinc(2+) subset: chebi_ph7_3 is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation is_a: CHEBI:63056 ! zinc cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29107 name: 24-methylidenelophenol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:29108 name: calcium(2+) subset: chebi_ph7_3 is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:39123 ! calcium cation is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29109 name: (+-)-5-[3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-1-naphthol is_a: CHEBI:25392 ! naphthols [Term] id: CHEBI:29110 name: (+-)-5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydronaphthalen-1(2H)-one is_a: CHEBI:25479 ! naphthalenone [Term] id: CHEBI:29111 name: alpha-D-GlcpNAc-(1->2)-[alpha-D-Manp-(1->3)]-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-D-Manp subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59268 ! amino pentasaccharide is_a: CHEBI:71288 ! (1->3)-alpha-D-mannooligosaccharide derivative [Term] id: CHEBI:29112 name: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate is_a: CHEBI:23638 ! deoxyribulose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29114 name: 2,5-diamino-4-hydroxy-6-(5-phosphoribosylamino)pyrimidine is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:38340 ! hydroxypyrimidine [Term] id: CHEBI:29118 name: methanophenazine subset: chebi_ph7_3 is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:29119 name: (2E,4Z)-deca-2,4-dienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA is_a: CHEBI:85555 ! (2E,4Z)-dienoyl-CoA [Term] id: CHEBI:29121 name: oxidonitrate(1-) is_a: CHEBI:35196 ! nitrogen oxide is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29123 name: 2-acetamido-5-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29125 name: arsenate(3-) is_a: CHEBI:22629 ! arsenate ion [Term] id: CHEBI:29126 name: trans-dec-3-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27700 ! trans-3-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:29133 name: dextrorphan is_a: CHEBI:25418 ! morphinane alkaloid [Term] id: CHEBI:29136 name: pyridine N-oxide subset: chebi_ph7_3 is_a: CHEBI:38189 ! pyridine N-oxides relationship: has_role CHEBI:49103 ! drug metabolite [Term] id: CHEBI:29152 name: Cys-tRNA(Cys) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29153 name: Phe-tRNA(Phe) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29154 name: Pro-tRNA(Pro) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29155 name: His-tRNA(His) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29156 name: Gly-tRNA(Gly) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29157 name: Glu-tRNA(Glu) is_a: CHEBI:13346 ! Glu-tRNA(Glx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29158 name: Asp-tRNA(Asp) is_a: CHEBI:13253 ! Asp-tRNA(Asx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29159 name: Trp-tRNA(Trp) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29160 name: Ile-tRNA(Ile) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29161 name: Tyr-tRNA(Tyr) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29162 name: Ser-tRNA(Ser) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29163 name: Thr-tRNA(Thr) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29164 name: Val-tRNA(Val) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29166 name: Gln-tRNA(Gln) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29167 name: tRNA(Cys) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29168 name: tRNA(Gln) is_a: CHEBI:15176 ! tRNA(Glx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29169 name: tRNA(Leu) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29170 name: tRNA(Ala) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29171 name: tRNA(Arg) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29172 name: tRNA(Asn) is_a: CHEBI:15172 ! tRNA(Asx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29173 name: tRNA(Met) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29174 name: tRNA(Ile) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29175 name: tRNA(Glu) is_a: CHEBI:15176 ! tRNA(Glx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29176 name: tRNA(Gly) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29177 name: tRNA(Pro) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29178 name: tRNA(His) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29179 name: tRNA(Ser) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29180 name: tRNA(Thr) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29181 name: tRNA(Trp) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29182 name: tRNA(Tyr) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29183 name: tRNA(Val) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29184 name: tRNA(Phe) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29185 name: tRNA(Lys) is_a: CHEBI:17843 ! transfer RNA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29186 name: tRNA(Asp) is_a: CHEBI:15172 ! tRNA(Asx) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29192 name: hydrogenperoxide(1-) is_a: CHEBI:33693 ! oxygen hydride [Term] id: CHEBI:29195 name: cyanate subset: chebi_ph7_3 is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36828 ! pseudohalide anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29198 name: phosphinate subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29200 name: thiocyanic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:33405 ! hydracid is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29202 name: isocyanic acid subset: chebi_ph7_3 is_a: CHEBI:33405 ! hydracid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:29210 name: trithionic acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:29213 name: sulfinic acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:29214 name: sulfonic acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:29216 name: 3-hydroxy-2-methylquinolin-4(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:29219 name: chlorous acid is_a: CHEBI:33426 ! chlorine oxoacid [Term] id: CHEBI:29222 name: hypochlorite is_a: CHEBI:33437 ! chlorine oxoanion is_a: CHEBI:37750 ! chlorine oxide is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29228 name: hydrogen fluoride is_a: CHEBI:18140 ! hydrogen halide is_a: CHEBI:37176 ! mononuclear parent hydride [Term] id: CHEBI:29241 name: silicate(4-) is_a: CHEBI:48123 ! silicate ion [Term] id: CHEBI:29242 name: arsenite(1-) subset: chebi_ph7_3 is_a: CHEBI:22633 ! arsenite ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29243 name: arsenite(2-) is_a: CHEBI:22633 ! arsenite ion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:29254 name: dihydrogenborate is_a: CHEBI:22909 ! borate ion [Term] id: CHEBI:29255 name: hydrogenborate is_a: CHEBI:22909 ! borate ion [Term] id: CHEBI:29256 name: thiol subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound relationship: has_part CHEBI:29917 ! thiol group [Term] id: CHEBI:29258 name: dihydrogenphosphite is_a: CHEBI:26045 ! phosphite ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29259 name: hydrogenphosphite is_a: CHEBI:26045 ! phosphite ion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:29264 name: tRNA(Sec) is_a: CHEBI:17843 ! transfer RNA [Term] id: CHEBI:29265 name: Asn-tRNA(Asn) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29269 name: selenophosphoric acid is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:29277 name: dinitride(2-) is_a: CHEBI:33266 ! diatomic nitrogen [Term] id: CHEBI:29278 name: dinitride(4-) is_a: CHEBI:33266 ! diatomic nitrogen [Term] id: CHEBI:29279 name: sulfurothioic O-acid is_a: CHEBI:33540 ! thiosulfuric acid [Term] id: CHEBI:29281 name: alkyl sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester [Term] id: CHEBI:29287 name: gold atom subset: chebi_ph7_3 is_a: CHEBI:33366 ! copper group element atom [Term] id: CHEBI:29289 name: S-alkyl thiosulfate is_a: CHEBI:37996 ! organic thiosulfate [Term] id: CHEBI:29317 name: selanide subset: chebi_ph7_3 is_a: CHEBI:36903 ! selenium hydride [Term] id: CHEBI:29323 name: methylazoxymethanol subset: chebi_ph7_3 is_a: CHEBI:37390 ! azoxy compound [Term] id: CHEBI:29337 name: azanide is_a: CHEBI:35106 ! nitrogen hydride is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29340 name: hydridonitrate(2-) is_a: CHEBI:35106 ! nitrogen hydride is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:29347 name: monocarboxylic acid amide subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:29348 name: fatty amide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:29356 name: oxide(2-) is_a: CHEBI:33264 ! monoatomic oxygen [Term] id: CHEBI:29360 name: methanediide subset: chebi_ph7_3 is_a: CHEBI:38222 ! hydrocarbyl anion [Term] id: CHEBI:29369 name: peroxy group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:2937 name: avenacoside A subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63571 ! trisaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:2938 name: avenacoside B subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63567 ! tetrasaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29396 name: disulfide(2-) is_a: CHEBI:33412 ! diatomic sulfur [Term] id: CHEBI:29412 name: oxonium is_a: CHEBI:33693 ! oxygen hydride is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:29434 name: carbide(4-) is_a: CHEBI:33419 ! monoatomic carbon [Term] id: CHEBI:29435 name: carbide(1-) is_a: CHEBI:33419 ! monoatomic carbon is_a: CHEBI:33429 ! monoatomic monoanion [Term] id: CHEBI:29438 name: methanide is_a: CHEBI:38222 ! hydrocarbyl anion [Term] id: CHEBI:29449 name: hydrogen azide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:29457 name: (5Z,7E,9E,14Z,17Z)-icosapentaenoic acid is_a: CHEBI:36006 ! icosapentaenoic acid [Term] id: CHEBI:29461 name: 10-deoxymethynolide subset: chebi_ph7_3 is_a: CHEBI:25106 ! macrolide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29472 name: 2-heptyl-3-hydroxy-4-quinolone subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:29474 name: (S)-3,5-dihydroxyphenylglycine is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:29476 name: 3-amino-4-hydroxybenzoic acid is_a: CHEBI:22495 ! aminobenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid [Term] id: CHEBI:29484 name: (S)-4,5-dihydroxypentane-2,3-dione subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:51869 ! alpha-diketone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29491 name: 5-O-beta-D-mycaminosyltylactone is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29505 name: A47934 is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:37919 ! aryl sulfate relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:29507 name: 3-amino-5-hydroxybenzoic acid is_a: CHEBI:22495 ! aminobenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid [Term] id: CHEBI:29509 name: abietal subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid [Term] id: CHEBI:29510 name: abietol subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid [Term] id: CHEBI:29514 name: 5-amino-5-deoxy-3-dehydroshikimic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:33707 ! gamma-amino acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:51689 ! enone [Term] id: CHEBI:29519 name: aphidicolan-16beta-ol subset: chebi_ph7_3 is_a: CHEBI:52557 ! tetracyclic diterpenoid [Term] id: CHEBI:29556 name: chloroeremomycin is_a: CHEBI:24396 ! glycopeptide is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29571 name: dehydroabietic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:29572 name: demethyllactenocin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:29579 name: epothilone D subset: chebi_ph7_3 is_a: CHEBI:60831 ! epothilone relationship: has_role CHEBI:61950 ! microtubule-stabilising agent [Term] id: CHEBI:29590 name: gibberellin A15 (diacid form) is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:29593 name: gibberellin A34 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid [Term] id: CHEBI:295975 name: choline phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29605 name: gibberellin A9 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29613 name: 3-O-(alpha-L-oleandrosyl)oleandolide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:25106 ! macrolide is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29614 name: 3-O-(alpha-L-olivosyl)oleandolide subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:25106 ! macrolide is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29616 name: abieta-8(14),12-diene subset: chebi_ph7_3 is_a: CHEBI:50072 ! abietadiene [Term] id: CHEBI:29630 name: methymycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29649 name: narbomycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29650 name: narbonolide subset: chebi_ph7_3 is_a: CHEBI:25106 ! macrolide is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29651 name: neoabietadiene subset: chebi_ph7_3 is_a: CHEBI:50072 ! abietadiene [Term] id: CHEBI:29656 name: neomethymycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29658 name: oleandolide subset: chebi_ph7_3 is_a: CHEBI:133131 ! spiro-epoxide is_a: CHEBI:25106 ! macrolide is_a: CHEBI:27136 ! triol is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:29665 name: pikromycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29669 name: pyochelin is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35622 ! thiazolidines relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26672 ! siderophore [Term] id: CHEBI:29673 name: rifamycin SV is_a: CHEBI:24995 ! lactam is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:26580 ! rifamycins is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:59779 ! cyclic ketal relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29678 name: sodium arsenite is_a: CHEBI:22632 ! arsenic molecular entity is_a: CHEBI:38702 ! inorganic sodium salt relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:33288 ! rodenticide relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:29700 name: tylactone subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25106 ! macrolide is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29701 name: tyrocidine A is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:29703 name: validamycin A is_a: CHEBI:26191 ! polyol is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83745 ! validamycins is_a: CHEBI:87114 ! antibiotic fungicide relationship: has_role CHEBI:83757 ! EC 2.4.1.231 [alpha,alpha-trehalose phosphorylase (configuration-retaining)] inhibitor relationship: has_role CHEBI:83760 ! EC 2.4.1.64 (alpha,alpha-trehalose phosphorylase) inhibitor relationship: has_role CHEBI:83762 ! EC 3.2.1.28 (alpha,alpha-trehalase) inhibitor relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:29704 name: valiolone subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:29706 name: 10-deoxymethymycin is_a: CHEBI:24400 ! glycoside is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:29726 name: dTDP-6-deoxy-alpha-D-allose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:29728 name: dTDP-alpha-D-mycaminose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:29739 name: 5alpha,9beta,10alpha-labda-8(20),13-dien-15-yl diphosphate is_a: CHEBI:23375 ! copalyl diphosphate [Term] id: CHEBI:29743 name: 3-oxododecanoate subset: chebi_ph7_3 is_a: CHEBI:133292 ! 3-oxo fatty acid anion [Term] id: CHEBI:29744 name: lithocholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29745 name: barbiturate is_a: CHEBI:22691 ! barbiturate anion [Term] id: CHEBI:29746 name: glycocholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29747 name: cholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29748 name: chorismate(2-) subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:29749 name: ferulate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:29750 name: 3-(indol-3-yl)pyruvic acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29751 name: (-)-quinate subset: chebi_ph7_3 is_a: CHEBI:26490 ! quinate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29753 name: arsonite(2-) is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:29754 name: arsonate(2-) is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:29772 name: hydroxyazanide is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:29773 name: aminooxidanide is_a: CHEBI:33458 ! nitrogen oxoanion [Term] id: CHEBI:29775 name: selenol group subset: chebi_ph7_3 is_a: CHEBI:24433 ! group [Term] id: CHEBI:29780 name: isochorismate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:29785 name: nitro group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group is_a: CHEBI:51144 ! nitrogen group [Term] id: CHEBI:2979 name: baicalein is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:139556 ! EC 4.1.1.17 (ornithine decarboxylase) inhibitor relationship: has_role CHEBI:147285 ! EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:49020 ! hormone antagonist relationship: has_role CHEBI:49023 ! prostaglandin antagonist relationship: has_role CHEBI:64995 ! EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:29792 name: hydroperoxy group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:29793 name: hydridodioxygen(1+) is_a: CHEBI:33693 ! oxygen hydride [Term] id: CHEBI:29805 name: glycolate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:29806 name: fumarate(2-) subset: chebi_ph7_3 is_a: CHEBI:36180 ! butenedioate is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29807 name: glycyrrhizinate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:2981 name: baicalin is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:38686 ! dihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:145947 ! antiatherosclerotic agent relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:170010 ! EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77307 ! cardioprotective agent [Term] id: CHEBI:29840 name: arsinic acid is_a: CHEBI:33407 ! arsenic oxoacid [Term] id: CHEBI:29846 name: arsinate subset: chebi_ph7_3 is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:29847 name: arsonous acid subset: chebi_ph7_3 is_a: CHEBI:50017 ! arsonous acids [Term] id: CHEBI:29850 name: arsonic acid is_a: CHEBI:50955 ! arsonic acids [Term] id: CHEBI:29852 name: methylarsonic acid is_a: CHEBI:22638 ! organoarsonic acid is_a: CHEBI:50955 ! arsonic acids is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:29864 name: mannitol is_a: CHEBI:24583 ! hexitol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29866 name: arsenite(3-) is_a: CHEBI:22633 ! arsenite ion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:29888 name: diphosphoric acid is_a: CHEBI:33457 ! phosphorus oxoacid is_a: CHEBI:37786 ! acyclic phosphorus acid anhydride relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:29917 name: thiol group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:29918 name: sulfanylium is_a: CHEBI:33535 ! sulfur hydride [Term] id: CHEBI:29919 name: hydrosulfide subset: chebi_ph7_3 is_a: CHEBI:33535 ! sulfur hydride relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29920 name: phosphoramidate subset: chebi_ph7_3 is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:29922 name: sulfo group is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:29924 name: hydrogenselenite is_a: CHEBI:33488 ! selenium oxoanion [Term] id: CHEBI:29934 name: (1s,4s)-prephenate(2-) subset: chebi_ph7_3 is_a: CHEBI:57852 ! prephenate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:29947 name: glycine residue subset: chebi_ph7_3 is_a: CHEBI:33700 ! proteinogenic amino-acid residue [Term] id: CHEBI:29950 name: L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:32460 ! cysteine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29951 name: D-cysteine residue is_a: CHEBI:32460 ! cysteine residue [Term] id: CHEBI:29952 name: L-arginine residue is_a: CHEBI:32700 ! arginine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29953 name: D-arginine residue is_a: CHEBI:32700 ! arginine residue [Term] id: CHEBI:29958 name: L-aspartic acid residue is_a: CHEBI:32470 ! aspartic acid residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29959 name: quinolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:132942 ! quinolinate is_a: CHEBI:36173 ! pyridinedicarboxylate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29961 name: L-aspartate residue subset: chebi_ph7_3 is_a: CHEBI:32471 ! aspartate residue is_a: CHEBI:33726 ! proteinogenic amino-acid residue anion [Term] id: CHEBI:29962 name: D-aspartate residue subset: chebi_ph7_3 is_a: CHEBI:32471 ! aspartate residue [Term] id: CHEBI:29963 name: D-cysteinate residue is_a: CHEBI:32461 ! cysteinate residue [Term] id: CHEBI:29964 name: L-cysteinate residue is_a: CHEBI:32461 ! cysteinate residue is_a: CHEBI:33726 ! proteinogenic amino-acid residue anion [Term] id: CHEBI:29965 name: L-argininium residue subset: chebi_ph7_3 is_a: CHEBI:32699 ! argininium residue is_a: CHEBI:33727 ! proteinogenic amino-acid residue cation [Term] id: CHEBI:29966 name: D-argininium residue is_a: CHEBI:32699 ! argininium residue [Term] id: CHEBI:29967 name: L-lysine residue is_a: CHEBI:32568 ! lysine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29968 name: D-lysine residue is_a: CHEBI:32568 ! lysine residue [Term] id: CHEBI:29969 name: L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:32579 ! lysinium residue is_a: CHEBI:33727 ! proteinogenic amino-acid residue cation [Term] id: CHEBI:29970 name: D-lysinium residue is_a: CHEBI:32579 ! lysinium residue [Term] id: CHEBI:29972 name: L-glutamic acid residue is_a: CHEBI:32483 ! glutamic acid residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29973 name: L-glutamate residue subset: chebi_ph7_3 is_a: CHEBI:32484 ! glutamate residue is_a: CHEBI:33726 ! proteinogenic amino-acid residue anion [Term] id: CHEBI:29974 name: D-glutamate residue is_a: CHEBI:32484 ! glutamate residue [Term] id: CHEBI:29976 name: D-tyrosine residue is_a: CHEBI:32789 ! tyrosine residue [Term] id: CHEBI:29979 name: L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:32535 ! histidine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:29980 name: D-histidine residue is_a: CHEBI:32535 ! histidine residue [Term] id: CHEBI:29981 name: D-histidinium residue is_a: CHEBI:32536 ! histidinium residue [Term] id: CHEBI:29982 name: L-histidinium residue is_a: CHEBI:32536 ! histidinium residue is_a: CHEBI:33727 ! proteinogenic amino-acid residue cation [Term] id: CHEBI:29984 name: D-methionine residue subset: chebi_ph7_3 is_a: CHEBI:32648 ! methionine residue [Term] id: CHEBI:29985 name: L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:14321 ! glutamate(1-) is_a: CHEBI:62031 ! polar amino acid zwitterion relationship: has_role CHEBI:24319 ! EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:29986 name: D-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:14321 ! glutamate(1-) [Term] id: CHEBI:29987 name: glutamate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29988 name: L-glutamate(2-) is_a: CHEBI:29987 ! glutamate(2-) is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:29989 name: D-glutamate(2-) is_a: CHEBI:29987 ! glutamate(2-) [Term] id: CHEBI:29990 name: D-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35391 ! aspartate(1-) relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29991 name: L-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35391 ! aspartate(1-) is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion is_a: CHEBI:62031 ! polar amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29993 name: L-aspartate(2-) is_a: CHEBI:29995 ! aspartate(2-) is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29994 name: D-aspartate(2-) is_a: CHEBI:29995 ! aspartate(2-) [Term] id: CHEBI:29995 name: aspartate(2-) is_a: CHEBI:132943 ! aspartate is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:29998 name: D-serine residue subset: chebi_ph7_3 is_a: CHEBI:32848 ! serine residue [Term] id: CHEBI:29999 name: L-serine residue subset: chebi_ph7_3 is_a: CHEBI:32848 ! serine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:300 name: (R)-(+)-alpha-terpineol subset: chebi_ph7_3 is_a: CHEBI:22469 ! alpha-terpineol [Term] id: CHEBI:30000 name: L-selenocysteine residue subset: chebi_ph7_3 is_a: CHEBI:32757 ! selenocysteine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:30001 name: D-selenocysteine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:9093 ! selenocysteine [Term] id: CHEBI:30002 name: D-selenocysteine residue is_a: CHEBI:32757 ! selenocysteine residue [Term] id: CHEBI:30003 name: L-selenocysteinate residue is_a: CHEBI:32758 ! selenocysteinate residue is_a: CHEBI:33726 ! proteinogenic amino-acid residue anion [Term] id: CHEBI:30004 name: D-selenocysteinate residue is_a: CHEBI:32758 ! selenocysteinate residue [Term] id: CHEBI:30011 name: L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:32677 ! glutamine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:30013 name: L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:32835 ! threonine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:30014 name: D-threonine residue subset: chebi_ph7_3 is_a: CHEBI:32835 ! threonine residue [Term] id: CHEBI:30018 name: D-proline residue subset: chebi_ph7_3 is_a: CHEBI:32874 ! proline residue [Term] id: CHEBI:30021 name: L-selenomethionine is_a: CHEBI:27585 ! selenomethionine [Term] id: CHEBI:30022 name: D-selenomethionine is_a: CHEBI:27585 ! selenomethionine [Term] id: CHEBI:30023 name: trans-sinapate subset: chebi_ph7_3 is_a: CHEBI:36091 ! cinnamates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30031 name: succinate(2-) subset: chebi_ph7_3 is_a: CHEBI:26806 ! succinate is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30033 name: bacteriochlorophyll a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38201 ! bacteriochlorophyll [Term] id: CHEBI:30037 name: taxa-4,11-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:30038 name: taxa-4(20),11-dien-5alpha-ol subset: chebi_ph7_3 is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:30041 name: taxa-4(20),11-dien-5alpha,13alpha-diol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:50367 ! taxane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:30042 name: taxa-4(20),11-dien-5alpha-yl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:30043 name: terephthalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:30049 name: teichoic acid is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:30065 name: thioglycolic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid [Term] id: CHEBI:30066 name: thioglycolate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:30081 name: dicarbide(2-) is_a: CHEBI:33420 ! diatomic carbon [Term] id: CHEBI:30087 name: guanidinium subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:30088 name: gibberellin A12 is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:30089 name: acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30094 name: diazenium is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30095 name: hydrazinide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30096 name: diazene subset: chebi_ph7_3 is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30099 name: diazynediium is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30100 name: hydrazine-1,2-diide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30101 name: hydrazine-1,1-diide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30102 name: diazynium is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30103 name: diazenide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30104 name: diazanetriide is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:30106 name: azo group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:30109 name: 4alpha-methyl-5alpha-ergosta-8,14,24(28)-trien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138031 ! Delta(14) steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:3015 name: benomyl subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:62733 ! aromatic amide is_a: CHEBI:87036 ! benzimidazole fungicide is_a: CHEBI:87064 ! benzimidazolylcarbamate fungicide relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:60832 ! tubulin modulator relationship: has_role CHEBI:61951 ! microtubule-destabilising agent relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:30154 name: 5beta-pregnane-3,20-dione subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30156 name: 6,7-dihydropteridine subset: chebi_ph7_3 is_a: CHEBI:13614 ! 6,7-dihydropteridines [Term] id: CHEBI:30164 name: 5-diphospho-1D-myo-inositol pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30166 name: boride(1-) is_a: CHEBI:33429 ! monoatomic monoanion is_a: CHEBI:33610 ! monoatomic boron [Term] id: CHEBI:30200 name: kaempferol 3-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:64634 ! kaempferol O-glucoside relationship: has_role CHEBI:36335 ! trypanocidal drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30212 name: photon subset: chebi_ph7_3 is_a: CHEBI:36341 ! boson [Term] id: CHEBI:30232 name: abieta-7,13-diene subset: chebi_ph7_3 is_a: CHEBI:50072 ! abietadiene [Term] id: CHEBI:30245 name: linoleate subset: chebi_ph7_3 is_a: CHEBI:25626 ! octadecadienoate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:30248 name: beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59412 ! amino tetrasaccharide [Term] id: CHEBI:30249 name: N-formyl-L-kynurenine is_a: CHEBI:18377 ! N-formylkynurenine is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30256 name: thiocarbonyl group subset: chebi_ph7_3 is_a: CHEBI:51422 ! organodiyl group [Term] id: CHEBI:30260 name: cyromazine is_a: CHEBI:38175 ! triamino-1,3,5-triazine relationship: has_role CHEBI:38060 ! triazine insecticide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:30297 name: antimonite is_a: CHEBI:36921 ! antimony oxoanion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:30305 name: N-methylanthraniloyl-CoA is_a: CHEBI:61940 ! aroyl-CoA [Term] id: CHEBI:30306 name: 1,3-dihydroxy-N-methylacridone subset: chebi_ph7_3 is_a: CHEBI:22213 ! acridines [Term] id: CHEBI:30307 name: N(alpha)-gamma-L-glutamylhistamine is_a: CHEBI:24323 ! glutamyl-L-amino acid [Term] id: CHEBI:30308 name: meso-2,6-diaminopimelate(2-) is_a: CHEBI:23671 ! 2,6-diaminopimelate(2-) [Term] id: CHEBI:30313 name: lipoate subset: chebi_ph7_3 is_a: CHEBI:59848 ! thia fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30314 name: (R)-lipoic acid is_a: CHEBI:16494 ! lipoic acid is_a: CHEBI:39192 ! dithiolanes is_a: CHEBI:48847 ! heterocyclic fatty acid is_a: CHEBI:59643 ! thia fatty acid relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:30316 name: dihydrolipoate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:59914 ! thio fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30318 name: (S)-dihydrolipoic acid is_a: CHEBI:18047 ! dihydrolipoic acid [Term] id: CHEBI:30320 name: thioacetate subset: chebi_ph7_3 is_a: CHEBI:35367 ! thiocarboxylic acid anion [Term] id: CHEBI:30322 name: 3-acetamidopropanal subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:30347 name: ethylenediamine is_a: CHEBI:35411 ! alkane-alpha,omega-diamine relationship: has_role CHEBI:51373 ! GABA agonist [Term] id: CHEBI:30353 name: isopropyl group subset: chebi_ph7_3 is_a: CHEBI:22323 ! alkyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:30356 name: isobutyl group subset: chebi_ph7_3 is_a: CHEBI:22323 ! alkyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:30362 name: isopentane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:30363 name: isobutane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:78017 ! food propellant relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:30366 name: imidazolide is_a: CHEBI:50335 ! organic nitrogen anion [Term] id: CHEBI:30367 name: pyrazol-1-ide is_a: CHEBI:38596 ! pyrazolide [Term] id: CHEBI:30395 name: acetylacetonate is_a: CHEBI:46640 ! diketone [Term] id: CHEBI:30407 name: 4-phospho-L-aspartate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:30408 name: iron-sulfur cluster subset: chebi_ph7_3 is_a: CHEBI:25214 ! metal-sulfur cluster is_a: CHEBI:33892 ! iron coordination entity [Term] id: CHEBI:30409 name: iron-sulfur-molybdenum cofactor subset: chebi_ph7_3 is_a: CHEBI:35202 ! molybdenum coordination entity relationship: has_part CHEBI:48796 ! iron-sulfur-molybdenum cluster relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:30411 name: cobalamin is_a: CHEBI:23334 ! cobalamins relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:30412 name: monoatomic dication subset: chebi_ph7_3 is_a: CHEBI:23906 ! monoatomic cation [Term] id: CHEBI:30413 name: heme subset: chebi_ph7_3 is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:33892 ! iron coordination entity is_a: CHEBI:33909 ! metallotetrapyrrole relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:30436 name: tetrahydropterin is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:30449 name: validamine is_a: CHEBI:61689 ! amino cyclitol [Term] id: CHEBI:30452 name: tellurium atom subset: chebi_ph7_3 is_a: CHEBI:137980 ! metalloid atom is_a: CHEBI:33303 ! chalcogen [Term] id: CHEBI:30465 name: tellurous acid is_a: CHEBI:33519 ! tellurium oxoacid [Term] id: CHEBI:30477 name: tellurite subset: chebi_ph7_3 is_a: CHEBI:33520 ! tellurium oxoanion [Term] id: CHEBI:30485 name: selenonium subset: chebi_ph7_3 is_a: CHEBI:36903 ! selenium hydride is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:30486 name: trihydridoselenate(1-) is_a: CHEBI:36903 ! selenium hydride [Term] id: CHEBI:30488 name: sulfonium is_a: CHEBI:26830 ! sulfonium compound is_a: CHEBI:33535 ! sulfur hydride is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:30490 name: tetrahydridooxygen(2+) is_a: CHEBI:33693 ! oxygen hydride [Term] id: CHEBI:30492 name: dioxidaniumyl is_a: CHEBI:36879 ! inorganic radical cation [Term] id: CHEBI:30512 name: silver atom subset: chebi_ph7_3 is_a: CHEBI:33366 ! copper group element atom [Term] id: CHEBI:30513 name: antimony atom subset: chebi_ph7_3 is_a: CHEBI:137980 ! metalloid atom is_a: CHEBI:33300 ! pnictogen [Term] id: CHEBI:30514 name: caesium atom subset: chebi_ph7_3 is_a: CHEBI:22314 ! alkali metal atom [Term] id: CHEBI:30526 name: 1-aminocyclopropanecarboxylate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:30527 name: flavin is_a: CHEBI:38925 ! benzopteridine [Term] id: CHEBI:30528 name: vanadium oxoanion is_a: CHEBI:35166 ! vanadium coordination entity is_a: CHEBI:35405 ! transition element oxoanion [Term] id: CHEBI:30531 name: pimelic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:30563 name: silicon dioxide subset: chebi_ph7_3 is_a: CHEBI:33327 ! silicon oxide [Term] id: CHEBI:30566 name: gamma-aminobutyrate is_a: CHEBI:71666 ! gamma-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:305790 name: thyroxine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:30584 name: silicon(4+) subset: chebi_ph7_3 is_a: CHEBI:26937 ! monoatomic tetracation is_a: CHEBI:37763 ! elemental silicon [Term] id: CHEBI:30585 name: silicide(1-) is_a: CHEBI:33429 ! monoatomic monoanion is_a: CHEBI:37763 ! elemental silicon [Term] id: CHEBI:30604 name: disulfanide is_a: CHEBI:33535 ! sulfur hydride [Term] id: CHEBI:30605 name: disulfanyl group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:30612 name: D-glucarate(2-) subset: chebi_ph7_3 is_a: CHEBI:30613 ! glucarate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30613 name: glucarate(2-) is_a: CHEBI:48914 ! glucaric acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30616 name: ATP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30619 name: 2,4-divinyl protochlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26354 ! protochlorophyllides is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:30620 name: (S)-2,3-dihydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:11421 ! 2,3-dihydrodipicolinate(2-) [Term] id: CHEBI:30623 name: oxalate(2-) subset: chebi_ph7_3 is_a: CHEBI:132952 ! oxalate is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30624 name: D-mannuronate subset: chebi_ph7_3 is_a: CHEBI:33821 ! mannuronate [Term] id: CHEBI:30632 name: loganic acid is_a: CHEBI:24278 ! glucoside is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30633 name: L-pipecolate is_a: CHEBI:36110 ! pipecolate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30653 name: homoserine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:30654 name: D-homoserine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:30653 ! homoserine [Term] id: CHEBI:30655 name: L-homoserine lactone is_a: CHEBI:17289 ! homoserine lactone [Term] id: CHEBI:30657 name: D-homoserine lactone is_a: CHEBI:17289 ! homoserine lactone [Term] id: CHEBI:30659 name: D-thyroxine is_a: CHEBI:30660 ! thyroxine is_a: CHEBI:84124 ! D-tyrosine derivative [Term] id: CHEBI:30660 name: thyroxine is_a: CHEBI:24863 ! iodophenol is_a: CHEBI:24864 ! iodothyronine is_a: CHEBI:53291 ! 2-halophenol is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:52290 ! mitogen [Term] id: CHEBI:30661 name: thyronine is_a: CHEBI:33853 ! phenols is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:30684 name: alpha-D-glucosyl group subset: chebi_ph7_3 is_a: CHEBI:24280 ! D-glucosyl group [Term] id: CHEBI:30697 name: beta-D-glucosyl group subset: chebi_ph7_3 is_a: CHEBI:24280 ! D-glucosyl group [Term] id: CHEBI:30719 name: citraconate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:30737 name: trichloromethyl(.) subset: chebi_ph7_3 is_a: CHEBI:36872 ! organic radical [Term] id: CHEBI:30742 name: ethylene glycol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:23976 ! ethanediol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:30744 name: oxaloacetic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:30745 name: phenylacetic acid is_a: CHEBI:22712 ! benzenes is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25978 ! phenylacetic acids relationship: has_role CHEBI:22676 ! auxin relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:35219 ! plant growth retardant relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:90318 ! EC 6.4.1.1 (pyruvate carboxylase) inhibitor [Term] id: CHEBI:30746 name: benzoic acid is_a: CHEBI:22723 ! benzoic acids relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:65001 ! EC 3.1.1.3 (triacylglycerol lipase) inhibitor relationship: has_role CHEBI:65256 ! antimicrobial food preservative relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:30747 name: 4-chlorobenzoic acid is_a: CHEBI:51967 ! monochlorobenzoic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:30748 name: 2,4-dichlorobenzoic acid is_a: CHEBI:23134 ! chlorobenzoic acid is_a: CHEBI:23697 ! dichlorobenzene relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:30749 name: 4-chlorophenylacetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:30751 name: formic acid is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:74783 ! astringent [Term] id: CHEBI:30753 name: 4-aminobenzoic acid is_a: CHEBI:22495 ! aminobenzoic acid relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:30754 name: anthranilic acid is_a: CHEBI:22495 ! aminobenzoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30762 name: salicylate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30763 name: 4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:30764 name: 3-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:30765 name: tropic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30766 name: (S)-tropic acid is_a: CHEBI:30765 ! tropic acid [Term] id: CHEBI:30767 name: (R)-tropic acid is_a: CHEBI:30765 ! tropic acid [Term] id: CHEBI:30768 name: propionic acid is_a: CHEBI:26607 ! saturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:30769 name: citric acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:64049 ! food acidity regulator relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30772 name: butyric acid is_a: CHEBI:140601 ! fatty acid 4:0 is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:30775 name: fluoroacetic acid is_a: CHEBI:16277 ! haloacetic acid is_a: CHEBI:37143 ! organofluorine compound relationship: has_role CHEBI:62608 ! EC 4.2.1.3 (aconitate hydratase) inhibitor [Term] id: CHEBI:30776 name: hexanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30778 name: gallic acid is_a: CHEBI:27115 ! trihydroxybenzoic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50629 ! cyclooxygenase 2 inhibitor relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:74783 ! astringent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30779 name: succinate(1-) is_a: CHEBI:26806 ! succinate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30780 name: maleate(2-) subset: chebi_ph7_3 is_a: CHEBI:132951 ! maleate is_a: CHEBI:36180 ! butenedioate is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30781 name: butynedioic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:30782 name: acetylenedicarboxylate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:30789 name: 4-sulfobenzoic acid is_a: CHEBI:26825 ! sulfobenzoic acid [Term] id: CHEBI:30793 name: 2-chlorobenzoic acid is_a: CHEBI:51967 ! monochlorobenzoic acid is_a: CHEBI:70862 ! 2-halobenzoic acid relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30794 name: malonic acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30795 name: malonate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:30796 name: (R)-malic acid is_a: CHEBI:6650 ! malic acid [Term] id: CHEBI:30797 name: (S)-malic acid is_a: CHEBI:6650 ! malic acid relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:30800 name: phthalate(1-) is_a: CHEBI:26092 ! phthalate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30801 name: terephthalate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:30805 name: dodecanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:30807 name: tetradecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion is_a: CHEBI:76928 ! 2,3-saturated fatty acid(1-) is_a: CHEBI:78121 ! fatty acid anion 14:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30813 name: decanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:30814 name: digallic acid is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:37576 ! gallate ester [Term] id: CHEBI:30816 name: vanillic acid is_a: CHEBI:25238 ! methoxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30817 name: trans-urocanic acid is_a: CHEBI:27248 ! urocanic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30820 name: 2-oxooctadecanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:30823 name: oleate subset: chebi_ph7_3 is_a: CHEBI:132944 ! octadec-9-enoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:30825 name: elaidate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:30827 name: cis-vaccenate(1-) subset: chebi_ph7_3 is_a: CHEBI:50498 ! vaccenate(1-) is_a: CHEBI:78049 ! octadecenoate [Term] id: CHEBI:30828 name: trans-vaccenate(1-) subset: chebi_ph7_3 is_a: CHEBI:50498 ! vaccenate(1-) is_a: CHEBI:78049 ! octadecenoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30830 name: 4-hydroxybutyric acid is_a: CHEBI:24684 ! hydroxybutyric acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid relationship: has_role CHEBI:35717 ! sedative relationship: has_role CHEBI:38869 ! general anaesthetic relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:53353 ! GHB receptor agonist [Term] id: CHEBI:30831 name: 2-oxobutanoic acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:30832 name: adipic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:64049 ! food acidity regulator relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30833 name: adipate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30835 name: 2-methylcitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:30837 name: allantoic acid is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30838 name: itaconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30839 name: orotate subset: chebi_ph7_3 is_a: CHEBI:38316 ! pyrimidinecarboxylate anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30841 name: 3-hydroxypyruvic acid is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30842 name: oxomalonic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:30843 name: oxomalonate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:30844 name: hydroxymalonate(1-) is_a: CHEBI:24711 ! hydroxymalonate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:30845 name: 2-furoic acid is_a: CHEBI:36055 ! furoic acid relationship: has_role CHEBI:35222 ! inhibitor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:30848 name: urate(1-) is_a: CHEBI:46818 ! urate anion [Term] id: CHEBI:30849 name: L-arabinose is_a: CHEBI:22599 ! arabinose relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:30850 name: 3-propylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:30851 name: keto-phenylpyruvic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:75050 ! chromogenic compound relationship: has_role CHEBI:78675 ! fundamental metabolite relationship: has_role CHEBI:90318 ! EC 6.4.1.1 (pyruvate carboxylase) inhibitor [Term] id: CHEBI:30852 name: galactaric acid is_a: CHEBI:24577 ! hexaric acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30853 name: glycyrrhetinic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30854 name: indole-3-acetate subset: chebi_ph7_3 is_a: CHEBI:38468 ! indol-3-yl carboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30859 name: 3-maleylpyruvic acid is_a: CHEBI:47940 ! 4,6-dioxohept-2-enedioic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:30860 name: methylmalonic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30861 name: methylmalonate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30864 name: (S)-dihydroorotate subset: chebi_ph7_3 is_a: CHEBI:30867 ! dihydroorotate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30865 name: dihydroorotic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26447 ! pyrimidinemonocarboxylic acid is_a: CHEBI:33257 ! secondary amide is_a: CHEBI:74266 ! N-acylurea [Term] id: CHEBI:30866 name: (R)-dihydroorotic acid is_a: CHEBI:30865 ! dihydroorotic acid [Term] id: CHEBI:30867 name: dihydroorotate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:30879 name: alcohol subset: chebi_ph7_3 is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:30881 name: xanthine-8-carboxylic acid is_a: CHEBI:38667 ! purinemonocarboxylic acid [Term] id: CHEBI:30882 name: 2-oxoglutaramic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:30885 name: lupinic acid is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:26385 ! purine alkaloid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:30887 name: isocitric acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30889 name: L-threo-isocitric acid is_a: CHEBI:30887 ! isocitric acid [Term] id: CHEBI:30896 name: L-threo-isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:16087 ! isocitrate(3-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30897 name: L-erythro-isocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:16087 ! isocitrate(3-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30903 name: (-)-homoisocitric acid is_a: CHEBI:29094 ! homoisocitric acid [Term] id: CHEBI:30904 name: homoisocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:30907 name: 4-fumarylacetoacetic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:30909 name: 1-alkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64590 ! monoalkyl-sn-glycero-3-phosphocholine is_a: CHEBI:78193 ! 1-alkylglycero-3-phosphocholine [Term] id: CHEBI:30911 name: glucitol is_a: CHEBI:24583 ! hexitol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30912 name: 1-piperideine-2-carboxylic acid is_a: CHEBI:26148 ! piperidinemonocarboxylic acid [Term] id: CHEBI:30913 name: L-pipecolic acid is_a: CHEBI:17964 ! pipecolic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30915 name: 2-oxoglutaric acid is_a: CHEBI:36145 ! oxo dicarboxylic acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30916 name: 2-oxoglutarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:30918 name: 3-dehydroshikimic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:35970 ! 4-hydroxy monocarboxylic acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:30920 name: 3-hydroxy-3-methylglutarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30921 name: glutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:24329 ! glutarate is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30923 name: 4-hydroxy-2-oxoglutaric acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:30924 name: L-tartrate(2-) subset: chebi_ph7_3 is_a: CHEBI:15193 ! tartrate(2-) [Term] id: CHEBI:30926 name: 3-oxalomalic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:30927 name: D-tartrate(2-) subset: chebi_ph7_3 is_a: CHEBI:15193 ! tartrate(2-) [Term] id: CHEBI:30928 name: meso-tartrate(2-) subset: chebi_ph7_3 is_a: CHEBI:30929 ! 2,3-dihydroxybutanedioate [Term] id: CHEBI:30929 name: 2,3-dihydroxybutanedioate subset: chebi_ph7_3 is_a: CHEBI:132950 ! tartrate is_a: CHEBI:61336 ! C4-dicarboxylate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:30933 name: 3-phosphonooxypyruvic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:30934 name: D-citramalate(2-) subset: chebi_ph7_3 is_a: CHEBI:13997 ! citramalate(2-) [Term] id: CHEBI:30935 name: 3-phosphonopyruvic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:30936 name: L-citramalate(2-) subset: chebi_ph7_3 is_a: CHEBI:13997 ! citramalate(2-) [Term] id: CHEBI:30938 name: 6-aminopenicillanate is_a: CHEBI:51356 ! penicillinate anion [Term] id: CHEBI:30939 name: 5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate is_a: CHEBI:23375 ! copalyl diphosphate [Term] id: CHEBI:30943 name: tyvelose subset: chebi_ph7_3 is_a: CHEBI:33983 ! deoxymannose [Term] id: CHEBI:30944 name: ascarylose is_a: CHEBI:23703 ! dideoxyhexose [Term] id: CHEBI:3095 name: biguanide is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:30959 name: 4-pyridoxate subset: chebi_ph7_3 is_a: CHEBI:132948 ! pyridoxate is_a: CHEBI:27306 ! vitamin B6 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:30960 name: 5-pyridoxate subset: chebi_ph7_3 is_a: CHEBI:132948 ! pyridoxate [Term] id: CHEBI:30968 name: azetidine is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:37949 ! azacycloalkane is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:3098 name: bile acid is_a: CHEBI:138366 ! bile acids is_a: CHEBI:24663 ! hydroxy-5beta-cholanic acid [Term] id: CHEBI:30984 name: evernitrose subset: chebi_ph7_3 is_a: CHEBI:63349 ! trideoxyhexose derivative [Term] id: CHEBI:30985 name: 4,4'-bipyridine subset: chebi_ph7_3 is_a: CHEBI:35545 ! bipyridine [Term] id: CHEBI:31 name: (+)-menthone subset: chebi_ph7_3 is_a: CHEBI:36503 ! menthone [Term] id: CHEBI:31001 name: octacosanoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31002 name: octacosanoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78130 ! fatty acid anion 28:0 [Term] id: CHEBI:31003 name: triacontanoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid [Term] id: CHEBI:31004 name: triacontanoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78131 ! fatty acid anion 30:0 [Term] id: CHEBI:31009 name: hexacosanoic acid is_a: CHEBI:191874 ! fatty acid 26:0 is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid [Term] id: CHEBI:31011 name: valerate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31013 name: cerotate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion is_a: CHEBI:78129 ! fatty acid anion 26:0 relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:31014 name: tetracosanoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78128 ! fatty acid anion 24:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:310312 name: isoliquiritigenin is_a: CHEBI:23086 ! chalcones relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50268 ! GABA modulator relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:60643 ! NMDA receptor antagonist [Term] id: CHEBI:31047 name: 10-carboxy-13-deoxycarminomycin is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:31056 name: 13-deoxycarminomycin is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:31057 name: 13-deoxydaunorubicin is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:31058 name: (13R)-13-dihydrocarminomycin is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:50912 ! cardiotoxic agent [Term] id: CHEBI:31059 name: 13-dihydrodaunorubicin is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:31069 name: 2,3,5-trichloro-cis,cis-muconic acid is_a: CHEBI:38448 ! trichloromuconic acid [Term] id: CHEBI:31080 name: 2-hydroxy-2,3-dihydrogenistein subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone [Term] id: CHEBI:31082 name: 2-hydroxy-6-oxonona-2,4,7-trienedioic acid is_a: CHEBI:49264 ! nonatrienedicarboxylic acid [Term] id: CHEBI:31087 name: 2-phytyl-1,4-naphthoquinone subset: chebi_ph7_3 is_a: CHEBI:26106 ! phylloquinones [Term] id: CHEBI:3110 name: biotinyl-5'-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:31103 name: 3,5-dihydroxyphenylacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:31104 name: 3,5-dihydroxyphenylglyoxylic acid is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:31107 name: 3-amino-4,7-dihydroxycoumarin is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:31111 name: 3-dimethylallyl-4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31112 name: 3-dimethylallyl-4-hydroxymandelic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:31113 name: 3-dimethylallyl-4-hydroxyphenylpyruvic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:31116 name: 3-hexaprenyl-4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:31121 name: 4'''-demalonylsalvianin is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:31128 name: 4-hydroxyphenyl acetate subset: chebi_ph7_3 is_a: CHEBI:140310 ! phenyl acetates is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:31132 name: 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylic acid is_a: CHEBI:49052 ! ureidocarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:31144 name: 8-demethyltetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:27136 ! triol is_a: CHEBI:47985 ! enol ether is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:31157 name: (+)-abscisic aldehyde subset: chebi_ph7_3 is_a: CHEBI:22144 ! abscisic aldehyde [Term] id: CHEBI:31178 name: aklanonic acid is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:37484 ! dihydroxyanthraquinone [Term] id: CHEBI:31181 name: aklavinone subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:31186 name: alfacalcidol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:36818 ! seco-cholestane is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:50646 ! bone density conservation agent [Term] id: CHEBI:31334 name: (E)-caffeyl alcohol subset: chebi_ph7_3 is_a: CHEBI:86071 ! caffeyl alcohol [Term] id: CHEBI:31355 name: carboplatin is_a: CHEBI:33862 ! platinum coordination entity relationship: has_part CHEBI:35690 ! cyclobutane-1,1-dicarboxylate(2-) relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:31359 name: carminomycin is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:31402 name: cinnamyl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:31432 name: corynebactin subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:37409 ! crown compound is_a: CHEBI:63944 ! macrocyclic lactone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:31445 name: cyclic ADP-beta-D-ribose is_a: CHEBI:25609 ! nucleotide-sugar is_a: CHEBI:36982 ! cyclic purine nucleotide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:67114 ! ryanodine receptor agonist [Term] id: CHEBI:31457 name: decanal subset: chebi_ph7_3 is_a: CHEBI:12834 ! n-alkanal is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:142621 ! medium-chain fatty aldehyde relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31459 name: 3,7,12-trioxo-5beta-cholanic acid is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:48070 ! 12-oxo steroid relationship: has_role CHEBI:55324 ! gastrointestinal drug [Term] id: CHEBI:31463 name: delphinidin 3-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31467 name: descarbamoylnovobiocin is_a: CHEBI:22702 ! benzamides is_a: CHEBI:35313 ! hexoside is_a: CHEBI:37912 ! hydroxycoumarin is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:31469 name: desmethyldescarbamoylnovobiocin is_a: CHEBI:22702 ! benzamides is_a: CHEBI:35313 ! hexoside is_a: CHEBI:37912 ! hydroxycoumarin is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:31488 name: N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:139048 ! dihydroceramide is_a: CHEBI:82829 ! sphinganine-based sphingolipid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:31529 name: ecgonine methyl ester is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35482 ! opioid analgesic relationship: has_role CHEBI:35488 ! central nervous system depressant relationship: has_role CHEBI:49110 ! peripheral nervous system drug relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:31549 name: epothilone A subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:60831 ! epothilone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:60832 ! tubulin modulator relationship: has_role CHEBI:61950 ! microtubule-stabilising agent [Term] id: CHEBI:31550 name: epothilone B subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:60831 ! epothilone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:61950 ! microtubule-stabilising agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:31577 name: ethylenediamine derivative is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:3163 name: bracteatin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:38830 ! 1-benzofurans relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:3165 name: bradykinin is_a: CHEBI:25676 ! oligopeptide relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:3168 name: brassicasterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50403 ! ergostanoid relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78728 ! EC 1.3.1.72 (Delta(24)-sterol reductase) inhibitor relationship: has_role CHEBI:83317 ! sterol biosynthesis inhibitor relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:31697 name: indolin-2-one subset: chebi_ph7_3 is_a: CHEBI:51625 ! indolinone is_a: CHEBI:74222 ! gamma-lactam [Term] id: CHEBI:31742 name: kaempferol 3-O-beta-D-galactoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:28034 ! beta-D-galactoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31746 name: kainic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:46767 ! pyrrolidinecarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative relationship: has_role CHEBI:35444 ! antinematodal drug relationship: has_role CHEBI:50103 ! excitatory amino acid agonist [Term] id: CHEBI:31748 name: 3-amino-3-deoxy-6-O-phosphono-D-glucopyranose is_a: CHEBI:22529 ! amino sugar phosphate [Term] id: CHEBI:31755 name: L-4-hydroxyphenylglycine is_a: CHEBI:50418 ! 4-hydroxyphenylglycine [Term] id: CHEBI:31763 name: laricitrin is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:138731 ! 5'-hydroxy-3'-methoxyflavone is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:25883 ! pentahydroxyflavone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:3179 name: bromobenzene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:37148 ! bromoarene is_a: CHEBI:37149 ! bromobenzenes relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:50908 ! hepatotoxic agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:31832 name: methyl salicylate subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26596 ! salicylates is_a: CHEBI:36054 ! benzoate ester relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:31883 name: N-oleoyldopamine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:157740 ! N-(fatty acyl)-dopamine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:140535 ! TRPV1 agonist [Term] id: CHEBI:31885 name: N-acetyl-L-2-aminoadipic acid is_a: CHEBI:21644 ! N-acyl-L-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:31887 name: N-acetyl-L-2-aminoadipic acid 6-phosphate is_a: CHEBI:36951 ! aminoacyl phosphate [Term] id: CHEBI:31915 name: nogalonic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:37484 ! dihydroxyanthraquinone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:31923 name: novobiocic acid is_a: CHEBI:22702 ! benzamides is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:31966 name: pelargonidin 3-O-(6-O-caffeoyl-beta-D-glucoside) 5-O-beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:31967 name: pelargonidin 3-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:71583 ! anthocyanidin glycoside relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:31968 name: pelargonidin 3-O-rutinoside is_a: CHEBI:26587 ! rutinoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:31969 name: pelargonidin 3-O-rutinoside 5-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26587 ! rutinoside is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:31997 name: N,N-dimethylethanolamine phosphate is_a: CHEBI:36711 ! phosphoethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:31998 name: N-acylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:32023 name: plaunotol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23849 ! diterpenoid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:49201 ! anti-ulcer drug relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:76595 ! nephroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32079 name: pyrrolnitrin subset: chebi_ph7_3 is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:32096 name: rhodomycin D is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:3211 name: bulbocapnine is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38104 ! oxacycle relationship: has_role CHEBI:53659 ! EC 1.4.3.22 (diamine oxidase) inhibitor relationship: has_role CHEBI:63932 ! EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32115 name: salvianin is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:32154 name: octadecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:197457 ! octadecanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:32167 name: 1,2-diacyl-3-(alpha-D-6-sulfoquinovosyl)-sn-glycerol is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:32197 name: tetracenomycin A2 subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones [Term] id: CHEBI:32202 name: tetracenomycin D3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones [Term] id: CHEBI:32205 name: tetracenomycin F1 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:48132 ! tetracenomycin [Term] id: CHEBI:32207 name: tetracenomycin F2 is_a: CHEBI:48132 ! tetracenomycin [Term] id: CHEBI:32274 name: UDP-3-keto-alpha-D-glucose is_a: CHEBI:17297 ! UDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:32275 name: UDP-alpha-D-kanosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:3230 name: butachlor subset: chebi_ph7_3 is_a: CHEBI:140326 ! tertiary carboxamide is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:62733 ! aromatic amide relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:32304 name: 2-cis,4-trans-xanthoxin subset: chebi_ph7_3 is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:35219 ! plant growth retardant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32325 name: beta-ionone subset: chebi_ph7_3 is_a: CHEBI:49248 ! ionone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:32328 name: 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)acrylic acid is_a: CHEBI:23469 ! cyclohexadienediol [Term] id: CHEBI:32333 name: dTDP-5,5-di-C-methyl-beta-L-lyxose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:32336 name: dTDP-beta-L-vancosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:32340 name: dTDP-beta-L-daunosamine is_a: CHEBI:23557 ! dTDP-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32356 name: 2,3-dihydroxy-trans-cinnamic acid is_a: CHEBI:48681 ! 2,3-dihydroxycinnamic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32357 name: trans-3-coumaric acid is_a: CHEBI:47925 ! 3-coumaric acid [Term] id: CHEBI:32360 name: icosanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:78126 ! fatty acid anion 20:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32361 name: nonanoate subset: chebi_ph7_3 is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32362 name: heptanoate subset: chebi_ph7_3 is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32364 name: 3-dehydroquinate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32365 name: heptadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:32366 name: margarate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78124 ! fatty acid anion 17:0 relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:32368 name: undecanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32369 name: undecanoate subset: chebi_ph7_3 is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32370 name: myristoleate subset: chebi_ph7_3 is_a: CHEBI:78896 ! tetradecenoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32372 name: palmitoleate subset: chebi_ph7_3 is_a: CHEBI:71449 ! hexadec-9-enoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32373 name: 4-coumarate subset: chebi_ph7_3 is_a: CHEBI:23399 ! coumarate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32374 name: trans-4-coumaric acid is_a: CHEBI:36090 ! 4-coumaric acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:32375 name: petroselinate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:78049 ! octadecenoate [Term] id: CHEBI:32379 name: cis,cis-muconate subset: chebi_ph7_3 is_a: CHEBI:36157 ! muconate relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:32381 name: dec-9-enoic acid is_a: CHEBI:36003 ! decenoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:32382 name: (R)-mandelate subset: chebi_ph7_3 is_a: CHEBI:25147 ! mandelate [Term] id: CHEBI:32383 name: 6-hydroxyhexanoate subset: chebi_ph7_3 is_a: CHEBI:194241 ! omega-hydroxy-medium-chain fatty acid anion [Term] id: CHEBI:32387 name: alpha-linolenate subset: chebi_ph7_3 is_a: CHEBI:133790 ! linolenate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32389 name: all-cis-octadeca-6,9,12,15-tetraenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:37810 ! octadecatetraenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:83038 ! Daphnia galeata metabolite [Term] id: CHEBI:32391 name: gamma-linolenate subset: chebi_ph7_3 is_a: CHEBI:133790 ! linolenate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32392 name: (15Z)-tetracosenoate subset: chebi_ph7_3 is_a: CHEBI:78068 ! tetracosenoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32393 name: erucate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:78076 ! docosenoate [Term] id: CHEBI:32395 name: arachidonate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62920 ! icosatetraenoate is_a: CHEBI:62937 ! icosanoid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32396 name: 6-aminohexanoate is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:32398 name: D-glyceric acid is_a: CHEBI:33508 ! glyceric acid [Term] id: CHEBI:32402 name: catecholate(2-) is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32408 name: parinaric acid is_a: CHEBI:37810 ! octadecatetraenoic acid [Term] id: CHEBI:32409 name: (9Z,11E,13E,15Z)-octadecatetraenoic acid is_a: CHEBI:32408 ! parinaric acid [Term] id: CHEBI:32414 name: cis-parinarate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:32425 name: (11Z)-icos-11-enoic acid is_a: CHEBI:23902 ! icosenoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32426 name: gondoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:78075 ! icosenoate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32431 name: L-alaninate is_a: CHEBI:32439 ! alaninate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32432 name: L-alaninium is_a: CHEBI:32440 ! alaninium relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32435 name: D-alaninate is_a: CHEBI:32439 ! alaninate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32436 name: D-alaninium is_a: CHEBI:32440 ! alaninium relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32439 name: alaninate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:32440 name: alaninium is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:32442 name: L-cysteinate(1-) is_a: CHEBI:32456 ! cysteinate(1-) is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32443 name: L-cysteinate(2-) is_a: CHEBI:32457 ! cysteinate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32445 name: L-cysteinium is_a: CHEBI:32458 ! cysteinium relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32446 name: all-trans-neoxanthin subset: chebi_ph7_3 is_a: CHEBI:25501 ! neoxanthin relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32447 name: L-cysteinyl group is_a: CHEBI:23511 ! cysteinyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue [Term] id: CHEBI:32448 name: L-cysteino group is_a: CHEBI:32459 ! cysteino group is_a: CHEBI:33717 ! C-terminal proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:32449 name: D-cysteinate(1-) is_a: CHEBI:32456 ! cysteinate(1-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32450 name: D-cysteinate(2-) is_a: CHEBI:32457 ! cysteinate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32451 name: D-cysteinium is_a: CHEBI:32458 ! cysteinium relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32452 name: D-cysteinyl group is_a: CHEBI:23511 ! cysteinyl group [Term] id: CHEBI:32453 name: D-cysteino group is_a: CHEBI:32459 ! cysteino group [Term] id: CHEBI:32456 name: cysteinate(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:32457 name: cysteinate(2-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32458 name: cysteinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32459 name: cysteino group is_a: CHEBI:24433 ! group [Term] id: CHEBI:32460 name: cysteine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32461 name: cysteinate residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:32462 name: L-alpha-aspartyl group is_a: CHEBI:22445 ! alpha-aspartyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue [Term] id: CHEBI:32466 name: D-alpha-aspartyl group is_a: CHEBI:22445 ! alpha-aspartyl group [Term] id: CHEBI:32470 name: aspartic acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32471 name: aspartate residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:32474 name: L-gamma-glutamyl group is_a: CHEBI:24190 ! gamma-glutamyl group [Term] id: CHEBI:32479 name: D-alpha-glutamyl group is_a: CHEBI:22453 ! alpha-glutamyl group [Term] id: CHEBI:32480 name: D-gamma-glutamyl group is_a: CHEBI:24190 ! gamma-glutamyl group [Term] id: CHEBI:32482 name: D-glutamo group is_a: CHEBI:24321 ! glutamo group [Term] id: CHEBI:32483 name: glutamic acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32484 name: glutamate residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:32486 name: L-phenylalaninate is_a: CHEBI:32504 ! phenylalaninate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32487 name: L-phenylalaninium is_a: CHEBI:32505 ! phenylalaninium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:324935 name: fumagillol subset: chebi_ph7_3 is_a: CHEBI:133131 ! spiro-epoxide is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:32494 name: D-phenylalaninate is_a: CHEBI:32504 ! phenylalaninate [Term] id: CHEBI:32495 name: D-phenylalaninium is_a: CHEBI:32505 ! phenylalaninium [Term] id: CHEBI:32504 name: phenylalaninate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:32505 name: phenylalaninium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32507 name: glycinium is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32508 name: glycinate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32510 name: L-histidinate(1-) is_a: CHEBI:32529 ! histidinate(1-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32511 name: L-histidinate(2-) is_a: CHEBI:32530 ! histidinate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32512 name: L-histidinium(2+) is_a: CHEBI:32532 ! histidinium(2+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32513 name: L-histidinium(1+) is_a: CHEBI:32531 ! histidinium(1+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32523 name: D-histidinate(1-) is_a: CHEBI:32529 ! histidinate(1-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32524 name: D-histidinate(2-) is_a: CHEBI:32530 ! histidinate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32526 name: D-histidinium(1+) is_a: CHEBI:32531 ! histidinium(1+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32527 name: D-histidinium(2+) is_a: CHEBI:32532 ! histidinium(2+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32529 name: histidinate(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32530 name: histidinate(2-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32531 name: histidinium(1+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32532 name: histidinium(2+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32535 name: histidine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32536 name: histidinium residue is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:32538 name: bacillosamine is_a: CHEBI:24271 ! glucosamines is_a: CHEBI:63349 ! trideoxyhexose derivative [Term] id: CHEBI:32539 name: daunosamine is_a: CHEBI:24586 ! hexosamine is_a: CHEBI:63349 ! trideoxyhexose derivative [Term] id: CHEBI:32544 name: nicotinate subset: chebi_ph7_3 is_a: CHEBI:176839 ! vitamin B3 is_a: CHEBI:38181 ! pyridinemonocarboxylate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32549 name: epsilon-carotene subset: chebi_ph7_3 is_a: CHEBI:139115 ! carotenoid epsilon-end derivative is_a: CHEBI:35163 ! cyclic carotene [Term] id: CHEBI:32550 name: L-lysinate is_a: CHEBI:32563 ! lysinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32551 name: L-lysinium(1+) subset: chebi_ph7_3 is_a: CHEBI:32564 ! lysinium(1+) is_a: CHEBI:62031 ! polar amino acid zwitterion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32552 name: L-lysinium(2+) is_a: CHEBI:32565 ! lysinium(2+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32553 name: L-lysyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue is_a: CHEBI:37903 ! lysyl group [Term] id: CHEBI:32556 name: D-lysinate is_a: CHEBI:32563 ! lysinate relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32557 name: D-lysinium(1+) subset: chebi_ph7_3 is_a: CHEBI:32564 ! lysinium(1+) relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32558 name: D-lysinium(2+) is_a: CHEBI:32565 ! lysinium(2+) relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32559 name: D-lysyl group is_a: CHEBI:37903 ! lysyl group [Term] id: CHEBI:32563 name: lysinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32564 name: lysinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32565 name: lysinium(2+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32568 name: lysine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32571 name: perosamine is_a: CHEBI:25166 ! mannosamine is_a: CHEBI:63346 ! deoxymannose derivative [Term] id: CHEBI:32579 name: lysinium residue is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:32587 name: 2-hydroxybenzoyl-CoA is_a: CHEBI:24678 ! hydroxybenzoyl-CoA [Term] id: CHEBI:32600 name: tetracene subset: chebi_ph7_3 is_a: CHEBI:35297 ! acene is_a: CHEBI:51270 ! tetracenes [Term] id: CHEBI:32604 name: L-isoleucinate is_a: CHEBI:32612 ! isoleucinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32605 name: L-isoleucinium is_a: CHEBI:32613 ! isoleucinium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32608 name: D-isoleucinate is_a: CHEBI:32612 ! isoleucinate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32609 name: D-isoleucinium is_a: CHEBI:32613 ! isoleucinium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32612 name: isoleucinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32613 name: isoleucinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32619 name: L-leucinate is_a: CHEBI:32627 ! leucinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32620 name: L-leucinium is_a: CHEBI:32628 ! leucinium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32622 name: L-leucino group is_a: CHEBI:32629 ! leucino group is_a: CHEBI:33717 ! C-terminal proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:32623 name: D-leucinate is_a: CHEBI:32627 ! leucinate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32624 name: D-leucinium is_a: CHEBI:32628 ! leucinium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32626 name: D-leucino group is_a: CHEBI:32629 ! leucino group [Term] id: CHEBI:326268 name: 1,4-butanediammonium subset: chebi_ph7_3 is_a: CHEBI:70977 ! alkane-alpha,omega-diammonium(2+) relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32627 name: leucinate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63471 ! branched-chain amino-acid anion [Term] id: CHEBI:32628 name: leucinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32629 name: leucino group is_a: CHEBI:24433 ! group [Term] id: CHEBI:32631 name: L-methioninate is_a: CHEBI:32644 ! methioninate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32632 name: L-methioninium is_a: CHEBI:32646 ! methioninium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32637 name: D-methioninate is_a: CHEBI:32644 ! methioninate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32638 name: D-methioninium is_a: CHEBI:32646 ! methioninium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32640 name: D-methionyl group is_a: CHEBI:37902 ! methionyl group [Term] id: CHEBI:32644 name: methioninate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:32646 name: methioninium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32648 name: methionine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32650 name: L-asparaginate is_a: CHEBI:32660 ! asparaginate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32651 name: L-asparaginium is_a: CHEBI:32661 ! asparaginium [Term] id: CHEBI:32653 name: D-asparaginyl group subset: chebi_ph7_3 is_a: CHEBI:22656 ! asparaginyl group [Term] id: CHEBI:32656 name: D-asparaginate is_a: CHEBI:32660 ! asparaginate [Term] id: CHEBI:32657 name: D-asparaginium is_a: CHEBI:32661 ! asparaginium [Term] id: CHEBI:32660 name: asparaginate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32661 name: asparaginium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32664 name: asparagine residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32665 name: L-glutaminate is_a: CHEBI:32678 ! glutaminate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32666 name: L-glutaminium is_a: CHEBI:32679 ! glutaminium [Term] id: CHEBI:32668 name: N(2)-L-glutamino group is_a: CHEBI:21816 ! N(2)-glutamino group is_a: CHEBI:33717 ! C-terminal proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:32672 name: D-glutaminate is_a: CHEBI:32678 ! glutaminate [Term] id: CHEBI:32673 name: D-glutaminium is_a: CHEBI:32679 ! glutaminium [Term] id: CHEBI:32675 name: N(2)-D-glutamino group is_a: CHEBI:21816 ! N(2)-glutamino group [Term] id: CHEBI:32677 name: glutamine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32678 name: glutaminate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32679 name: glutaminium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32681 name: L-argininate is_a: CHEBI:32695 ! argininate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32682 name: L-argininium(1+) subset: chebi_ph7_3 is_a: CHEBI:32696 ! argininium(1+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32683 name: L-argininium(2+) is_a: CHEBI:32697 ! argininium(2+) [Term] id: CHEBI:32688 name: D-argininate is_a: CHEBI:32695 ! argininate [Term] id: CHEBI:32689 name: D-argininium(1+) subset: chebi_ph7_3 is_a: CHEBI:32696 ! argininium(1+) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32690 name: D-argininium(2+) is_a: CHEBI:32697 ! argininium(2+) [Term] id: CHEBI:32695 name: argininate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32696 name: argininium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32697 name: argininium(2+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32699 name: argininium residue is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:32700 name: arginine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32702 name: L-tryptophanate is_a: CHEBI:32727 ! tryptophanate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32704 name: L-tryptophanium is_a: CHEBI:32728 ! tryptophanium relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32716 name: D-tryptophanate is_a: CHEBI:32727 ! tryptophanate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32717 name: D-tryptophanium is_a: CHEBI:32728 ! tryptophanium relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32721 name: glycyl radical is_a: CHEBI:33544 ! alpha-amino-acid radical relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32722 name: glycyl radical residue subset: chebi_ph7_3 is_a: CHEBI:33728 ! proteinogenic amino-acid residue radical [Term] id: CHEBI:32727 name: tryptophanate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32728 name: tryptophanium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32742 name: L-selenocysteinate(1-) is_a: CHEBI:32752 ! selenocysteinate(1-) [Term] id: CHEBI:32743 name: L-selenocysteinate(2-) is_a: CHEBI:32753 ! selenocysteinate(2-) [Term] id: CHEBI:32744 name: L-selenocysteinium is_a: CHEBI:32754 ! selenocysteinium [Term] id: CHEBI:32747 name: D-selenocysteinate(1-) is_a: CHEBI:32752 ! selenocysteinate(1-) [Term] id: CHEBI:32750 name: D-selenocysteinate(2-) is_a: CHEBI:32753 ! selenocysteinate(2-) [Term] id: CHEBI:32751 name: D-selenocysteinium is_a: CHEBI:32754 ! selenocysteinium [Term] id: CHEBI:32752 name: selenocysteinate(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32753 name: selenocysteinate(2-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32754 name: selenocysteinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32757 name: selenocysteine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32758 name: selenocysteinate residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:32760 name: L-tyrosinate(1-) is_a: CHEBI:32784 ! tyrosinate(1-) is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32761 name: L-tyrosinate(2-) is_a: CHEBI:32785 ! tyrosinate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32762 name: L-tyrosinium is_a: CHEBI:32786 ! tyrosinium relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32764 name: L-tyrosyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue is_a: CHEBI:37898 ! tyrosyl group [Term] id: CHEBI:32773 name: D-tyrosinate(1-) is_a: CHEBI:32784 ! tyrosinate(1-) relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32774 name: D-tyrosinate(2-) is_a: CHEBI:32785 ! tyrosinate(2-) relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32775 name: D-tyrosinium is_a: CHEBI:32786 ! tyrosinium relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32778 name: D-tyrosyl group is_a: CHEBI:37898 ! tyrosyl group [Term] id: CHEBI:32784 name: tyrosinate(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32785 name: tyrosinate(2-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32786 name: tyrosinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32789 name: tyrosine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32796 name: (R)-2-hydroxyglutaric acid is_a: CHEBI:17084 ! 2-hydroxyglutaric acid relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:32797 name: (S)-2-hydroxyglutaric acid is_a: CHEBI:17084 ! 2-hydroxyglutaric acid [Term] id: CHEBI:32798 name: 9-cis,11-trans-octadecadienoic acid is_a: CHEBI:36025 ! octadeca-9,11-dienoic acid [Term] id: CHEBI:327995 name: tyraminium subset: chebi_ph7_3 is_a: CHEBI:25375 ! monoamine molecular messenger is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32800 name: (S)-mandelic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:35825 ! mandelic acid [Term] id: CHEBI:32802 name: (S)-4-hydroxymandelic acid is_a: CHEBI:16388 ! 4-hydroxymandelic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid [Term] id: CHEBI:32803 name: (R)-4-hydroxymandelic acid is_a: CHEBI:16388 ! 4-hydroxymandelic acid [Term] id: CHEBI:32804 name: 4-hydroxymandelate subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:58896 ! 2-hydroxy carboxylate [Term] id: CHEBI:32805 name: cis-aconitic acid is_a: CHEBI:22211 ! aconitic acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32806 name: trans-aconitic acid is_a: CHEBI:22211 ! aconitic acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32807 name: o-orsellinic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:32808 name: (Z)-5-oxohex-2-enedioic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:32809 name: 3-hydroxy-L-glutamic acid is_a: CHEBI:24659 ! hydroxy-L-glutamic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:32810 name: 3-hydroxy-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32811 name: 4-hydroxy-L-glutamic acid is_a: CHEBI:24659 ! hydroxy-L-glutamic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:32812 name: 4-hydroxy-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32813 name: N-amidino-L-aspartate(2-) is_a: CHEBI:24436 ! guanidines is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:32814 name: N-carbamoyl-L-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:58865 ! N-carbamoyl-L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32815 name: enol-phenylpyruvic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:32816 name: pyruvic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32817 name: keto-3-deoxy-D-manno-octulosonic acid is_a: CHEBI:11791 ! 3-deoxy-D-manno-octulosonic acid [Term] id: CHEBI:32818 name: p-coumaroylagmatine is_a: CHEBI:23247 ! cinnamamides is_a: CHEBI:24436 ! guanidines is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:32819 name: L-2-amino-4-chloropent-4-enoate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32820 name: L-threoninate is_a: CHEBI:32832 ! threoninate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32822 name: L-threoninium is_a: CHEBI:32833 ! threoninium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32826 name: D-allothreonine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:38262 ! allothreonine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32827 name: D-threoninate is_a: CHEBI:32832 ! threoninate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32828 name: D-threoninium is_a: CHEBI:32833 ! threoninium relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:32832 name: threoninate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32833 name: threoninium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32835 name: threonine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32836 name: L-serinate is_a: CHEBI:32845 ! serinate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:32837 name: L-serinium is_a: CHEBI:32846 ! serinium [Term] id: CHEBI:32840 name: D-serinate is_a: CHEBI:32845 ! serinate [Term] id: CHEBI:32841 name: D-serinium is_a: CHEBI:32846 ! serinium [Term] id: CHEBI:32844 name: N-acetyl-4-O-acetylneuraminic acid is_a: CHEBI:21569 ! N-acetyl-O-acetylneuraminic acid [Term] id: CHEBI:32845 name: serinate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32846 name: serinium is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:32848 name: serine residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32851 name: L-valinate is_a: CHEBI:32859 ! valinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32852 name: L-valinium is_a: CHEBI:32860 ! valinium relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32855 name: D-valinate is_a: CHEBI:32859 ! valinate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32856 name: D-valinium is_a: CHEBI:32860 ! valinium relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32859 name: valinate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63471 ! branched-chain amino-acid anion [Term] id: CHEBI:32860 name: valinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32862 name: L-prolinate is_a: CHEBI:32871 ! prolinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32863 name: secondary amine is_a: CHEBI:32952 ! amine is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:32864 name: L-prolinium is_a: CHEBI:32872 ! prolinium relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32867 name: D-prolinate is_a: CHEBI:32871 ! prolinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32868 name: D-prolinium is_a: CHEBI:32872 ! prolinium relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32871 name: prolinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32872 name: prolinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:32874 name: proline residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:32875 name: methyl group subset: chebi_ph7_3 is_a: CHEBI:22323 ! alkyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:32876 name: tertiary amine subset: chebi_ph7_3 is_a: CHEBI:32952 ! amine is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:32877 name: primary amine is_a: CHEBI:32952 ! amine is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:32878 name: alkene is_a: CHEBI:33645 ! acyclic olefin [Term] id: CHEBI:32879 name: propane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:78017 ! food propellant [Term] id: CHEBI:32888 name: gamma-hexachlorocyclohexane subset: chebi_ph7_3 is_a: CHEBI:23457 ! cyclodiene organochlorine insecticide is_a: CHEBI:24536 ! hexachlorocyclohexane relationship: has_role CHEBI:24127 ! fungicide relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:33288 ! rodenticide relationship: has_role CHEBI:38706 ! pediculicide relationship: has_role CHEBI:38999 ! GABA-gated chloride channel antagonist relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:32892 name: nonane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32896 name: (2R)-O-phospho-3-sulfolactic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate is_a: CHEBI:38031 ! carboxyalkanesulfonic acid [Term] id: CHEBI:32897 name: 10-deacetyl-2-debenzoylbaccatin III subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:52557 ! tetracyclic diterpenoid [Term] id: CHEBI:32898 name: baccatin III subset: chebi_ph7_3 is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32902 name: gibberellin A4 is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:25000 ! lactone is_a: CHEBI:38305 ! gibberellin monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32906 name: gibberellin A24 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:20859 ! C20-gibberellin is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32922 name: (1S,2R)-3-phenylcyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:15599 ! cis-3-phenylcyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:32926 name: octadecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:32940 name: hexacosane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32952 name: amine is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:32955 name: epoxide subset: chebi_ph7_3 is_a: CHEBI:37407 ! cyclic ether [Term] id: CHEBI:32957 name: lysophosphatidic acids is_a: CHEBI:16961 ! monoacylglycerol phosphate [Term] id: CHEBI:32958 name: phosphate group is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:32963 name: amidinoproclavaminic acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35627 ! beta-lactam is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:83965 ! L-arginine derivative [Term] id: CHEBI:32964 name: ornithinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:32965 name: N(3')-acetylgentamycin C is_a: CHEBI:21826 ! N(3')-acetylgentamycin [Term] id: CHEBI:32966 name: beta-D-fructofuranose 1,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:49299 ! D-fructofuranose 1,6-bisphosphate(4-) [Term] id: CHEBI:32969 name: D-lombricine is_a: CHEBI:25072 ! lombricine [Term] id: CHEBI:32970 name: 2-aminoethanesulfonate is_a: CHEBI:62081 ! 1,1-diunsubstituted alkanesulfonate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:32971 name: 3,4,6-trichlorocatechol is_a: CHEBI:27097 ! trichlorocatechol [Term] id: CHEBI:32975 name: (R)-2,3,4,5-tetrahydrodipicolinic acid is_a: CHEBI:32976 ! 2,3,4,5-tetrahydrodipicolinic acid [Term] id: CHEBI:32976 name: 2,3,4,5-tetrahydrodipicolinic acid is_a: CHEBI:26921 ! tetrahydropyridine is_a: CHEBI:36164 ! amino dicarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:32978 name: (R)-3-phenyllactic acid is_a: CHEBI:17893 ! (2R)-2-hydroxy monocarboxylic acid is_a: CHEBI:25998 ! 3-phenyllactic acid [Term] id: CHEBI:32979 name: (S)-3-phenyllactate subset: chebi_ph7_3 is_a: CHEBI:58123 ! (2S)-2-hydroxy monocarboxylic acid anion is_a: CHEBI:8100 ! 3-phenyllactate [Term] id: CHEBI:32980 name: phloretic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:32988 name: amide is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:32989 name: N(omega)-phosphohypotaurocyamine is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:33007 name: chromium(6+) subset: chebi_ph7_3 is_a: CHEBI:33423 ! monoatomic hexacation is_a: CHEBI:33516 ! chromium cation [Term] id: CHEBI:33010 name: chromide(1-) is_a: CHEBI:33429 ! monoatomic monoanion is_a: CHEBI:61310 ! chromium ion [Term] id: CHEBI:33017 name: diphosphate(1-) is_a: CHEBI:35782 ! diphosphate ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:33019 name: diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35782 ! diphosphate ion is_a: CHEBI:79387 ! trivalent inorganic anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33020 name: kojibiose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:33033 name: 2-oxopentanoic acid is_a: CHEBI:25799 ! oxopentanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:3306 name: calcitonin is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25905 ! peptide hormone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50646 ! bone density conservation agent [Term] id: CHEBI:33070 name: indole-3-butyric acid is_a: CHEBI:24810 ! indol-3-yl carboxylic acid relationship: has_role CHEBI:22676 ! auxin relationship: has_role CHEBI:37848 ! plant hormone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33076 name: D-mannonic acid is_a: CHEBI:21054 ! mannonic acid [Term] id: CHEBI:330772 name: dichloroarcyriaflavin A subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:51914 ! organic heterohexacyclic compound is_a: CHEBI:51915 ! indolocarbazole [Term] id: CHEBI:33082 name: phenalene subset: chebi_ph7_3 is_a: CHEBI:35300 ! ortho- and peri-fused polycyclic arene is_a: CHEBI:51120 ! ortho- and peri-fused tricyclic hydrocarbon [Term] id: CHEBI:33094 name: (S)-3-aminoisobutyric acid is_a: CHEBI:27389 ! 3-aminoisobutyric acid is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33101 name: nitrogen dioxide subset: chebi_ph7_3 is_a: CHEBI:35196 ! nitrogen oxide [Term] id: CHEBI:33113 name: tetrathionate(1-) is_a: CHEBI:26936 ! tetrathionate ion [Term] id: CHEBI:33114 name: disulfane subset: chebi_ph7_3 is_a: CHEBI:33535 ! sulfur hydride is_a: CHEBI:50425 ! inorganic disulfide [Term] id: CHEBI:33118 name: boric acid subset: chebi_ph7_3 is_a: CHEBI:59765 ! boric acids relationship: has_role CHEBI:74783 ! astringent [Term] id: CHEBI:33140 name: pyrazolium is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:33143 name: chromic acid is_a: CHEBI:35401 ! chromium oxoacid relationship: has_role CHEBI:63248 ! oxidising agent [Term] id: CHEBI:33144 name: hydrogenchromate is_a: CHEBI:35402 ! chromium oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:33145 name: boron oxoacid is_a: CHEBI:22916 ! boron molecular entity is_a: CHEBI:24833 ! oxoacid [Term] id: CHEBI:33163 name: dec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion [Term] id: CHEBI:33173 name: benzimidazolide is_a: CHEBI:50335 ! organic nitrogen anion [Term] id: CHEBI:33184 name: long-chain fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:33190 name: 3-oxopropanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33196 name: (3R)-3-hydroxy-L-aspartate(2-) is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:33197 name: (R)-10-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid [Term] id: CHEBI:33198 name: D-gluconic acid is_a: CHEBI:24266 ! gluconic acid relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:33199 name: propynoic acid is_a: CHEBI:25380 ! acetylenic fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:73477 ! terminal acetylenic compound is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:33203 name: (Z)-24-ethylidenelophenol subset: chebi_ph7_3 is_a: CHEBI:138130 ! Delta(7)-sterol is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:33216 name: bisphenol A subset: chebi_ph7_3 is_a: CHEBI:22901 ! bisphenol relationship: has_role CHEBI:138015 ! endocrine disruptor relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:76988 ! xenoestrogen relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:33221 name: corrin is_a: CHEBI:23392 ! corrins is_a: CHEBI:35794 ! tetrapyrrole fundamental parent relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:33224 name: chromane subset: chebi_ph7_3 is_a: CHEBI:23230 ! chromanes [Term] id: CHEBI:33227 name: (E)-cinnamyl alcohol subset: chebi_ph7_3 is_a: CHEBI:17177 ! cinnamyl alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33229 name: vitamin (role) is_a: CHEBI:27027 ! micronutrient is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:33231 name: antitubercular agent is_a: CHEBI:64912 ! antimycobacterial drug [Term] id: CHEBI:33232 name: application is_a: CHEBI:50906 ! role [Term] id: CHEBI:33233 name: fundamental particle is_a: CHEBI:36342 ! subatomic particle [Term] id: CHEBI:33234 name: vitamin E is_a: CHEBI:23229 ! chromanol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:24020 ! fat-soluble vitamin (role) [Term] id: CHEBI:33235 name: tocotrienol is_a: CHEBI:39437 ! tocol [Term] id: CHEBI:33237 name: vitamin D4 subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D is_a: CHEBI:36819 ! seco-ergostane relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:33238 name: monoatomic entity is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:33240 name: coordination entity is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:33241 name: oxoacid derivative is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:33242 name: inorganic hydride is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:33692 ! hydrides [Term] id: CHEBI:33245 name: organic fundamental parent is_a: CHEBI:37175 ! organic hydride is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33246 name: inorganic group is_a: CHEBI:24433 ! group [Term] id: CHEBI:33247 name: organic group is_a: CHEBI:24433 ! group [Term] id: CHEBI:33248 name: hydrocarbyl group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:33249 name: organyl group is_a: CHEBI:51447 ! organic univalent group [Term] id: CHEBI:33250 name: atom is_a: CHEBI:24431 ! chemical entity relationship: has_part CHEBI:10545 ! electron relationship: has_part CHEBI:33252 ! atomic nucleus [Term] id: CHEBI:33251 name: monoatomic hydrogen is_a: CHEBI:33238 ! monoatomic entity is_a: CHEBI:33260 ! elemental hydrogen [Term] id: CHEBI:33252 name: atomic nucleus is_a: CHEBI:36347 ! nuclear particle relationship: has_part CHEBI:33253 ! nucleon [Term] id: CHEBI:33253 name: nucleon is_a: CHEBI:36339 ! baryon is_a: CHEBI:36347 ! nuclear particle [Term] id: CHEBI:33255 name: alkylmercury compound is_a: CHEBI:25706 ! organomercury compound [Term] id: CHEBI:33256 name: primary amide is_a: CHEBI:32988 ! amide [Term] id: CHEBI:33257 name: secondary amide is_a: CHEBI:32988 ! amide [Term] id: CHEBI:33259 name: elemental molecular entity is_a: CHEBI:23367 ! molecular entity [Term] id: CHEBI:33260 name: elemental hydrogen is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:33259 ! elemental molecular entity is_a: CHEBI:33608 ! hydrogen molecular entity [Term] id: CHEBI:33261 name: organosulfur compound is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:36962 ! organochalcogen compound [Term] id: CHEBI:33262 name: elemental oxygen is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:25806 ! oxygen molecular entity is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:33263 name: diatomic oxygen is_a: CHEBI:33262 ! elemental oxygen [Term] id: CHEBI:33264 name: monoatomic oxygen is_a: CHEBI:33238 ! monoatomic entity is_a: CHEBI:33262 ! elemental oxygen [Term] id: CHEBI:33265 name: triatomic oxygen is_a: CHEBI:33262 ! elemental oxygen [Term] id: CHEBI:33266 name: diatomic nitrogen is_a: CHEBI:33267 ! elemental nitrogen [Term] id: CHEBI:33267 name: elemental nitrogen is_a: CHEBI:33465 ! elemental pnictogen is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:33270 name: alpha-tocotrienol subset: chebi_ph7_3 is_a: CHEBI:33234 ! vitamin E is_a: CHEBI:33235 ! tocotrienol relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33271 name: aldimine is_a: CHEBI:24783 ! imine [Term] id: CHEBI:33272 name: ketimine is_a: CHEBI:24783 ! imine [Term] id: CHEBI:33273 name: polyatomic anion is_a: CHEBI:22563 ! anion is_a: CHEBI:36358 ! polyatomic ion [Term] id: CHEBI:33275 name: beta-tocotrienol subset: chebi_ph7_3 is_a: CHEBI:33234 ! vitamin E is_a: CHEBI:33235 ! tocotrienol relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33276 name: delta-tocotrienol subset: chebi_ph7_3 is_a: CHEBI:33234 ! vitamin E is_a: CHEBI:33235 ! tocotrienol relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33277 name: gamma-tocotrienol subset: chebi_ph7_3 is_a: CHEBI:33234 ! vitamin E is_a: CHEBI:33235 ! tocotrienol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:66987 ! radiation protective agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33279 name: vitamin D5 subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D [Term] id: CHEBI:33280 name: molecular messenger is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:33281 name: antimicrobial agent is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:33282 name: antibacterial agent is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:33284 name: nutrient is_a: CHEBI:78295 ! food component [Term] id: CHEBI:33285 name: heteroorganic entity is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33286 name: agrochemical is_a: CHEBI:33232 ! application [Term] id: CHEBI:33287 name: fertilizer is_a: CHEBI:33286 ! agrochemical [Term] id: CHEBI:33288 name: rodenticide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:33289 name: avicide is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:33292 name: fuel is_a: CHEBI:33232 ! application [Term] id: CHEBI:33295 name: diagnostic agent is_a: CHEBI:52217 ! pharmaceutical [Term] id: CHEBI:33296 name: alkali metal molecular entity is_a: CHEBI:33674 ! s-block molecular entity relationship: has_part CHEBI:22314 ! alkali metal atom [Term] id: CHEBI:33299 name: alkaline earth molecular entity is_a: CHEBI:33674 ! s-block molecular entity relationship: has_part CHEBI:22313 ! alkaline earth metal atom [Term] id: CHEBI:33300 name: pnictogen is_a: CHEBI:33560 ! p-block element atom [Term] id: CHEBI:33301 name: bismuth atom subset: chebi_ph7_3 is_a: CHEBI:33300 ! pnictogen is_a: CHEBI:33521 ! metal atom [Term] id: CHEBI:33302 name: pnictogen molecular entity is_a: CHEBI:33675 ! p-block molecular entity relationship: has_part CHEBI:33300 ! pnictogen [Term] id: CHEBI:33303 name: chalcogen is_a: CHEBI:33560 ! p-block element atom [Term] id: CHEBI:33304 name: chalcogen molecular entity is_a: CHEBI:33675 ! p-block molecular entity relationship: has_part CHEBI:33303 ! chalcogen [Term] id: CHEBI:33305 name: tellurium molecular entity is_a: CHEBI:33304 ! chalcogen molecular entity relationship: has_part CHEBI:30452 ! tellurium atom [Term] id: CHEBI:33306 name: carbon group element atom is_a: CHEBI:33560 ! p-block element atom [Term] id: CHEBI:33307 name: thiocarboxylic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:64709 ! organic acid [Term] id: CHEBI:33308 name: carboxylic ester subset: chebi_ph7_3 is_a: CHEBI:35701 ! ester is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:33317 name: boron group element atom is_a: CHEBI:33560 ! p-block element atom [Term] id: CHEBI:33318 name: main group element atom is_a: CHEBI:33250 ! atom [Term] id: CHEBI:33327 name: silicon oxide is_a: CHEBI:24836 ! inorganic oxide is_a: CHEBI:26677 ! silicon molecular entity [Term] id: CHEBI:33328 name: silicon oxoacid is_a: CHEBI:24833 ! oxoacid is_a: CHEBI:46890 ! silicon hydroxide relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:33338 name: aryl group is_a: CHEBI:33248 ! hydrocarbyl group [Term] id: CHEBI:33340 name: zinc group element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33347 name: vanadium group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33350 name: chromium group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33352 name: manganese group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33356 name: iron group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33358 name: cobalt group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33362 name: nickel group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33364 name: platinum subset: chebi_ph7_3 is_a: CHEBI:33362 ! nickel group element atom is_a: CHEBI:33365 ! platinum group metal atom [Term] id: CHEBI:33365 name: platinum group metal atom is_a: CHEBI:27081 ! transition element atom [Term] id: CHEBI:33366 name: copper group element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33384 name: L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35243 ! serine zwitterion [Term] id: CHEBI:33402 name: sulfur oxoacid is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:33484 ! chalcogen oxoacid [Term] id: CHEBI:33403 name: elemental sulfur is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:33404 name: 3-hydroxypropionic acid is_a: CHEBI:194306 ! omega-hydroxy-short-chain fatty acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33405 name: hydracid is_a: CHEBI:33608 ! hydrogen molecular entity relationship: has_role CHEBI:39141 ! Bronsted acid [Term] id: CHEBI:33406 name: organoarsenic compound is_a: CHEBI:143084 ! organometalloidal compound is_a: CHEBI:22632 ! arsenic molecular entity [Term] id: CHEBI:33407 name: arsenic oxoacid is_a: CHEBI:22632 ! arsenic molecular entity is_a: CHEBI:33408 ! pnictogen oxoacid [Term] id: CHEBI:33408 name: pnictogen oxoacid is_a: CHEBI:24833 ! oxoacid is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:33409 name: methylarsonate(1-) subset: chebi_ph7_3 is_a: CHEBI:50956 ! organoarsonic acid anion [Term] id: CHEBI:33410 name: arsonite(1-) is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:33412 name: diatomic sulfur is_a: CHEBI:33403 ! elemental sulfur [Term] id: CHEBI:33415 name: elemental carbon is_a: CHEBI:33259 ! elemental molecular entity is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33419 name: monoatomic carbon is_a: CHEBI:33238 ! monoatomic entity is_a: CHEBI:33415 ! elemental carbon [Term] id: CHEBI:33420 name: diatomic carbon is_a: CHEBI:33415 ! elemental carbon [Term] id: CHEBI:33423 name: monoatomic hexacation subset: chebi_ph7_3 is_a: CHEBI:25430 ! monoatomic polycation [Term] id: CHEBI:33424 name: sulfur oxoacid derivative is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:33241 ! oxoacid derivative [Term] id: CHEBI:33425 name: halogen oxoacid is_a: CHEBI:24471 ! halogen molecular entity is_a: CHEBI:24833 ! oxoacid relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:33426 name: chlorine oxoacid is_a: CHEBI:23117 ! chlorine molecular entity is_a: CHEBI:33425 ! halogen oxoacid [Term] id: CHEBI:33429 name: monoatomic monoanion subset: chebi_ph7_3 is_a: CHEBI:23905 ! monoatomic anion is_a: CHEBI:36830 ! monoanion [Term] id: CHEBI:33431 name: elemental chlorine is_a: CHEBI:23117 ! chlorine molecular entity is_a: CHEBI:33434 ! elemental halogen [Term] id: CHEBI:33432 name: monoatomic chlorine is_a: CHEBI:33431 ! elemental chlorine is_a: CHEBI:33433 ! monoatomic halogen [Term] id: CHEBI:33433 name: monoatomic halogen is_a: CHEBI:33238 ! monoatomic entity [Term] id: CHEBI:33434 name: elemental halogen is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:33437 name: chlorine oxoanion is_a: CHEBI:23117 ! chlorine molecular entity is_a: CHEBI:33443 ! halogen oxoanion [Term] id: CHEBI:33443 name: halogen oxoanion is_a: CHEBI:24471 ! halogen molecular entity is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:33447 name: phospho sugar is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:33452 name: benzylic group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:33455 name: nitrogen oxoacid is_a: CHEBI:33408 ! pnictogen oxoacid is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:33456 name: organoheteryl group is_a: CHEBI:51447 ! organic univalent group [Term] id: CHEBI:33457 name: phosphorus oxoacid is_a: CHEBI:33408 ! pnictogen oxoacid is_a: CHEBI:36360 ! phosphorus oxoacids and derivatives [Term] id: CHEBI:33458 name: nitrogen oxoanion is_a: CHEBI:33459 ! pnictogen oxoanion is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:33459 name: pnictogen oxoanion is_a: CHEBI:33302 ! pnictogen molecular entity is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:33461 name: phosphorus oxoanion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:26082 ! phosphorus molecular entity is_a: CHEBI:33459 ! pnictogen oxoanion [Term] id: CHEBI:33462 name: phosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:33465 name: elemental pnictogen is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:33259 ! elemental molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity [Term] id: CHEBI:3347 name: candesartan is_a: CHEBI:35688 ! benzimidazolecarboxylic acid is_a: CHEBI:48420 ! biphenylyltetrazole relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:61016 ! angiotensin receptor antagonist relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:33482 name: sulfur oxoanion is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:33485 ! chalcogen oxoanion [Term] id: CHEBI:33483 name: trithionate(1-) is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:33484 name: chalcogen oxoacid is_a: CHEBI:24833 ! oxoacid is_a: CHEBI:33304 ! chalcogen molecular entity relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:33485 name: chalcogen oxoanion is_a: CHEBI:33304 ! chalcogen molecular entity is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:33488 name: selenium oxoanion is_a: CHEBI:26628 ! selenium molecular entity is_a: CHEBI:33485 ! chalcogen oxoanion [Term] id: CHEBI:33489 name: selenium oxoacid is_a: CHEBI:26628 ! selenium molecular entity is_a: CHEBI:33484 ! chalcogen oxoacid [Term] id: CHEBI:3349 name: candicidin D is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:26177 ! polyene antibiotic relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:33490 name: hydrogenselenate is_a: CHEBI:33488 ! selenium oxoanion [Term] id: CHEBI:33497 name: transition element molecular entity is_a: CHEBI:23367 ! molecular entity relationship: has_part CHEBI:27081 ! transition element atom [Term] id: CHEBI:33504 name: alkali metal cation is_a: CHEBI:25213 ! metal cation [Term] id: CHEBI:33507 name: diketoaldonic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:33508 name: glyceric acid is_a: CHEBI:33754 ! trionic acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:33509 name: arabinonic acid is_a: CHEBI:33753 ! pentonic acid [Term] id: CHEBI:33510 name: L-arabinonic acid is_a: CHEBI:33509 ! arabinonic acid [Term] id: CHEBI:33511 name: ribonic acid is_a: CHEBI:33753 ! pentonic acid [Term] id: CHEBI:33513 name: alkaline earth cation is_a: CHEBI:25213 ! metal cation is_a: CHEBI:33299 ! alkaline earth molecular entity [Term] id: CHEBI:33515 name: transition element cation is_a: CHEBI:25213 ! metal cation [Term] id: CHEBI:33516 name: chromium cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:61310 ! chromium ion [Term] id: CHEBI:33519 name: tellurium oxoacid is_a: CHEBI:33305 ! tellurium molecular entity is_a: CHEBI:33484 ! chalcogen oxoacid [Term] id: CHEBI:33520 name: tellurium oxoanion is_a: CHEBI:33305 ! tellurium molecular entity is_a: CHEBI:33485 ! chalcogen oxoanion [Term] id: CHEBI:33521 name: metal atom is_a: CHEBI:33250 ! atom [Term] id: CHEBI:33522 name: hydrogentellurite is_a: CHEBI:33520 ! tellurium oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:33526 name: mannonate is_a: CHEBI:33866 ! mannonates [Term] id: CHEBI:33527 name: ribonate is_a: CHEBI:33869 ! ribonates [Term] id: CHEBI:33529 name: idonate is_a: CHEBI:33867 ! idonates [Term] id: CHEBI:33530 name: altronate is_a: CHEBI:33868 ! altronates [Term] id: CHEBI:33532 name: altronic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:33535 name: sulfur hydride is_a: CHEBI:26835 ! sulfur molecular entity is_a: CHEBI:36902 ! chalcogen hydride [Term] id: CHEBI:33539 name: hydroxidodioxidosulfidosulfate(1-) is_a: CHEBI:33541 ! thiosulfate(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33540 name: thiosulfuric acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:33541 name: thiosulfate(1-) is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:33542 name: trioxidosulfanidosulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:33541 ! thiosulfate(1-) [Term] id: CHEBI:33543 name: sulfonate subset: chebi_ph7_3 is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:33544 name: alpha-amino-acid radical is_a: CHEBI:36872 ! organic radical [Term] id: CHEBI:33549 name: uronate is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:33551 name: organosulfonic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:33552 ! sulfonic acid derivative is_a: CHEBI:64709 ! organic acid relationship: has_part CHEBI:29922 ! sulfo group relationship: has_part CHEBI:33249 ! organyl group [Term] id: CHEBI:33552 name: sulfonic acid derivative is_a: CHEBI:33424 ! sulfur oxoacid derivative [Term] id: CHEBI:33554 name: organosulfonate oxoanion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:33555 name: arenesulfonic acid is_a: CHEBI:33551 ! organosulfonic acid relationship: has_part CHEBI:33338 ! aryl group [Term] id: CHEBI:33557 name: aminobenzenesulfonic acid is_a: CHEBI:33555 ! arenesulfonic acid is_a: CHEBI:37793 ! amino sulfonic acid [Term] id: CHEBI:33558 name: alpha-amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:33559 name: s-block element atom is_a: CHEBI:33250 ! atom [Term] id: CHEBI:33560 name: p-block element atom is_a: CHEBI:33318 ! main group element atom [Term] id: CHEBI:33561 name: d-block element atom is_a: CHEBI:27081 ! transition element atom is_a: CHEBI:33521 ! metal atom [Term] id: CHEBI:33563 name: glycolipid is_a: CHEBI:35740 ! liposaccharide [Term] id: CHEBI:33564 name: dihydroxybenzenesulfonate is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:33565 name: 2,3-dihydroxybenzenesulfonate subset: chebi_ph7_3 is_a: CHEBI:33564 ! dihydroxybenzenesulfonate [Term] id: CHEBI:33566 name: catechols subset: chebi_ph7_3 is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:33567 name: catecholamine is_a: CHEBI:25375 ! monoamine molecular messenger is_a: CHEBI:33566 ! catechols is_a: CHEBI:64365 ! aralkylamino compound [Term] id: CHEBI:33568 name: adrenaline is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:28918 ! (R)-adrenaline relationship: has_part CHEBI:40751 ! (S)-adrenaline relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:33569 name: noradrenaline is_a: CHEBI:33567 ! catecholamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:33570 name: benzenediols is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:33571 name: (S)-noradrenaline is_a: CHEBI:33569 ! noradrenaline [Term] id: CHEBI:33572 name: resorcinols is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:33573 name: tetrol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:33574 name: 4-methylthio-2-oxobutanoic acid is_a: CHEBI:134529 ! omega-(methylthio)-2-oxocarboxylic acid [Term] id: CHEBI:33575 name: carboxylic acid is_a: CHEBI:35605 ! carbon oxoacid is_a: CHEBI:36586 ! carbonyl compound is_a: CHEBI:64709 ! organic acid relationship: has_part CHEBI:46883 ! carboxy group [Term] id: CHEBI:33576 name: sulfur-containing carboxylic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:33579 name: main group molecular entity is_a: CHEBI:23367 ! molecular entity relationship: has_part CHEBI:33318 ! main group element atom [Term] id: CHEBI:33581 name: boron group molecular entity is_a: CHEBI:33675 ! p-block molecular entity relationship: has_part CHEBI:33317 ! boron group element atom [Term] id: CHEBI:33582 name: carbon group molecular entity is_a: CHEBI:33675 ! p-block molecular entity relationship: has_part CHEBI:33306 ! carbon group element atom [Term] id: CHEBI:33585 name: lead molecular entity is_a: CHEBI:33582 ! carbon group molecular entity relationship: has_part CHEBI:25016 ! lead atom [Term] id: CHEBI:3359 name: cannabidiolic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:67196 ! phytocannabinoid [Term] id: CHEBI:33595 name: cyclic compound is_a: CHEBI:25367 ! molecule [Term] id: CHEBI:33596 name: inorganic heterocyclic compound is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:33597 name: homocyclic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:33598 name: carbocyclic compound is_a: CHEBI:33597 ! homocyclic compound is_a: CHEBI:33832 ! organic cyclic compound [Term] id: CHEBI:33599 name: spiro compound is_a: CHEBI:33635 ! polycyclic compound [Term] id: CHEBI:33608 name: hydrogen molecular entity is_a: CHEBI:33674 ! s-block molecular entity relationship: has_part CHEBI:49637 ! hydrogen atom [Term] id: CHEBI:33609 name: elemental boron is_a: CHEBI:22916 ! boron molecular entity is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:33610 name: monoatomic boron is_a: CHEBI:33238 ! monoatomic entity is_a: CHEBI:33609 ! elemental boron [Term] id: CHEBI:33613 name: 2,2-bis(4-hydroxyphenyl)propan-1-ol subset: chebi_ph7_3 is_a: CHEBI:22901 ! bisphenol is_a: CHEBI:26279 ! propan-1-ols [Term] id: CHEBI:33619 name: boron oxoanion is_a: CHEBI:22916 ! boron molecular entity is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:3362 name: canthaxanthin subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77182 ! food colouring [Term] id: CHEBI:33620 name: aluminium molecular entity is_a: CHEBI:33581 ! boron group molecular entity relationship: has_part CHEBI:28984 ! aluminium atom [Term] id: CHEBI:33624 name: bromophenol is_a: CHEBI:37149 ! bromobenzenes is_a: CHEBI:38856 ! halophenol [Term] id: CHEBI:33625 name: dibromophenol is_a: CHEBI:33624 ! bromophenol [Term] id: CHEBI:33628 name: elemental aluminium is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:33259 ! elemental molecular entity is_a: CHEBI:33620 ! aluminium molecular entity [Term] id: CHEBI:33635 name: polycyclic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:33636 name: bicyclic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:33637 name: ortho-fused compound is_a: CHEBI:35293 ! fused compound [Term] id: CHEBI:33639 name: ortho- and peri-fused compound is_a: CHEBI:35293 ! fused compound [Term] id: CHEBI:33641 name: olefin is_a: CHEBI:24632 ! hydrocarbon is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:33642 name: cyclic olefin is_a: CHEBI:33641 ! olefin is_a: CHEBI:33654 ! alicyclic compound [Term] id: CHEBI:33643 name: cycloalkene is_a: CHEBI:33664 ! monocyclic hydrocarbon is_a: CHEBI:36403 ! monocyclic olefin [Term] id: CHEBI:33644 name: acetylenes is_a: CHEBI:24632 ! hydrocarbon is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:33645 name: acyclic olefin is_a: CHEBI:33641 ! olefin [Term] id: CHEBI:33646 name: alkadiene is_a: CHEBI:33645 ! acyclic olefin [Term] id: CHEBI:33647 name: alkatriene is_a: CHEBI:33645 ! acyclic olefin [Term] id: CHEBI:33650 name: acyclic acetylene is_a: CHEBI:33644 ! acetylenes [Term] id: CHEBI:33653 name: aliphatic compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33654 name: alicyclic compound is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:33653 ! aliphatic compound [Term] id: CHEBI:33655 name: aromatic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:33658 name: arene is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:33663 ! cyclic hydrocarbon [Term] id: CHEBI:33659 name: organic aromatic compound is_a: CHEBI:33655 ! aromatic compound is_a: CHEBI:33832 ! organic cyclic compound [Term] id: CHEBI:33661 name: monocyclic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:33662 name: annulene is_a: CHEBI:33664 ! monocyclic hydrocarbon [Term] id: CHEBI:33663 name: cyclic hydrocarbon is_a: CHEBI:24632 ! hydrocarbon is_a: CHEBI:33598 ! carbocyclic compound [Term] id: CHEBI:33664 name: monocyclic hydrocarbon is_a: CHEBI:33663 ! cyclic hydrocarbon [Term] id: CHEBI:33666 name: polycyclic hydrocarbon is_a: CHEBI:33663 ! cyclic hydrocarbon is_a: CHEBI:35294 ! carbopolycyclic compound [Term] id: CHEBI:33670 name: heteromonocyclic compound is_a: CHEBI:33661 ! monocyclic compound is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:33671 name: heteropolycyclic compound is_a: CHEBI:33635 ! polycyclic compound is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:33672 name: heterobicyclic compound is_a: CHEBI:33636 ! bicyclic compound is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:33673 name: zinc group molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33340 ! zinc group element atom [Term] id: CHEBI:33674 name: s-block molecular entity is_a: CHEBI:33579 ! main group molecular entity relationship: has_part CHEBI:33559 ! s-block element atom [Term] id: CHEBI:33675 name: p-block molecular entity is_a: CHEBI:33579 ! main group molecular entity relationship: has_part CHEBI:33560 ! p-block element atom [Term] id: CHEBI:33676 name: d-block molecular entity is_a: CHEBI:33497 ! transition element molecular entity relationship: has_part CHEBI:33561 ! d-block element atom [Term] id: CHEBI:33692 name: hydrides is_a: CHEBI:33608 ! hydrogen molecular entity is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:33693 name: oxygen hydride is_a: CHEBI:36902 ! chalcogen hydride [Term] id: CHEBI:33694 name: biomacromolecule is_a: CHEBI:33839 ! macromolecule is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33695 name: information biomacromolecule is_a: CHEBI:33694 ! biomacromolecule [Term] id: CHEBI:33696 name: nucleic acid is_a: CHEBI:15986 ! polynucleotide relationship: has_part CHEBI:33791 ! canonical nucleoside residue relationship: has_part CHEBI:50297 ! canonical nucleotide residue [Term] id: CHEBI:33697 name: ribonucleic acid is_a: CHEBI:33696 ! nucleic acid relationship: has_part CHEBI:33792 ! canonical ribonucleoside residue relationship: has_part CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:33699 name: messenger RNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:33700 name: proteinogenic amino-acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:33702 name: polyatomic cation is_a: CHEBI:36358 ! polyatomic ion is_a: CHEBI:36916 ! cation [Term] id: CHEBI:33703 name: amino-acid cation is_a: CHEBI:33702 ! polyatomic cation [Term] id: CHEBI:33704 name: alpha-amino acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:33706 name: beta-amino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:33707 name: gamma-amino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:33708 name: amino-acid residue is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:33709 name: amino acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:33710 name: alpha-amino-acid residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:33711 name: C-terminal amino-acid residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:33712 name: N-terminal amino-acid residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:33713 name: C-terminal alpha-amino-acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue is_a: CHEBI:33711 ! C-terminal amino-acid residue [Term] id: CHEBI:33715 name: N-terminal alpha-amino-acid residue is_a: CHEBI:33710 ! alpha-amino-acid residue is_a: CHEBI:33712 ! N-terminal amino-acid residue [Term] id: CHEBI:33716 name: N-terminal proteinogenic amino-acid residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:33715 ! N-terminal alpha-amino-acid residue [Term] id: CHEBI:33717 name: C-terminal proteinogenic amino-acid residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:33713 ! C-terminal alpha-amino-acid residue [Term] id: CHEBI:33719 name: alpha-amino-acid cation is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:33720 name: carbohydrate acid is_a: CHEBI:16646 ! carbohydrate is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:33721 name: carbohydrate acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:33722 name: tetra-mu3-sulfido-tetrairon(2+) subset: chebi_ph7_3 is_a: CHEBI:49883 ! tetra-mu3-sulfido-tetrairon [Term] id: CHEBI:33723 name: tetra-mu3-sulfido-tetrairon(1+) subset: chebi_ph7_3 is_a: CHEBI:49883 ! tetra-mu3-sulfido-tetrairon [Term] id: CHEBI:33726 name: proteinogenic amino-acid residue anion is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:33727 name: proteinogenic amino-acid residue cation is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:33728 name: proteinogenic amino-acid residue radical is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:35417 ! alpha-amino-acid residue radical [Term] id: CHEBI:33729 name: tetritol is_a: CHEBI:17522 ! alditol [Term] id: CHEBI:33731 name: cluster is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:33733 name: heteronuclear cluster is_a: CHEBI:33731 ! cluster [Term] id: CHEBI:33737 name: di-mu-sulfido-diiron(2+) subset: chebi_ph7_3 is_a: CHEBI:190135 ! di-mu-sulfido-diiron [Term] id: CHEBI:33738 name: di-mu-sulfido-diiron(1+) subset: chebi_ph7_3 is_a: CHEBI:190135 ! di-mu-sulfido-diiron [Term] id: CHEBI:33741 name: chromium group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33350 ! chromium group element atom [Term] id: CHEBI:33742 name: tungsten molecular entity is_a: CHEBI:33741 ! chromium group molecular entity relationship: has_part CHEBI:27998 ! tungsten [Term] id: CHEBI:33743 name: manganese group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33352 ! manganese group element atom [Term] id: CHEBI:33744 name: iron group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33356 ! iron group element atom [Term] id: CHEBI:33745 name: copper group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33366 ! copper group element atom [Term] id: CHEBI:33746 name: vanadium group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33347 ! vanadium group element atom [Term] id: CHEBI:33747 name: nickel group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33362 ! nickel group element atom [Term] id: CHEBI:33748 name: nickel molecular entity is_a: CHEBI:33747 ! nickel group molecular entity relationship: has_part CHEBI:28112 ! nickel atom [Term] id: CHEBI:33749 name: platinum molecular entity is_a: CHEBI:33747 ! nickel group molecular entity relationship: has_part CHEBI:33364 ! platinum [Term] id: CHEBI:3375 name: capsanthin subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33752 name: hexonic acid is_a: CHEBI:22301 ! aldonic acid [Term] id: CHEBI:33753 name: pentonic acid is_a: CHEBI:22301 ! aldonic acid [Term] id: CHEBI:33754 name: trionic acid is_a: CHEBI:22301 ! aldonic acid [Term] id: CHEBI:33755 name: tetronic acid is_a: CHEBI:22301 ! aldonic acid [Term] id: CHEBI:33760 name: hexonate is_a: CHEBI:22299 ! aldonate [Term] id: CHEBI:33761 name: pentonate is_a: CHEBI:22299 ! aldonate [Term] id: CHEBI:33762 name: tetronate is_a: CHEBI:22299 ! aldonate [Term] id: CHEBI:33763 name: trionate is_a: CHEBI:22299 ! aldonate [Term] id: CHEBI:33764 name: arabinonates is_a: CHEBI:33761 ! pentonate [Term] id: CHEBI:33767 name: cobalt group molecular entity is_a: CHEBI:33497 ! transition element molecular entity is_a: CHEBI:33676 ! d-block molecular entity relationship: has_part CHEBI:33358 ! cobalt group element atom [Term] id: CHEBI:33769 name: fuconates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33772 name: gluconic acid derivative is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:33778 name: galactonates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:3378 name: capsorubin subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone [Term] id: CHEBI:33791 name: canonical nucleoside residue is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:33792 name: canonical ribonucleoside residue is_a: CHEBI:33791 ! canonical nucleoside residue [Term] id: CHEBI:33793 name: canonical deoxyribonucleoside residue is_a: CHEBI:33791 ! canonical nucleoside residue [Term] id: CHEBI:33794 name: tRNA(fMet) is_a: CHEBI:17843 ! transfer RNA [Term] id: CHEBI:33797 name: glucaric acid derivative is_a: CHEBI:63438 ! hexaric acid derivative [Term] id: CHEBI:33798 name: tetraric acid anion is_a: CHEBI:22289 ! aldaric acid anion [Term] id: CHEBI:33801 name: D-glucarate(1-) is_a: CHEBI:35392 ! glucarate(1-) [Term] id: CHEBI:33804 name: gluconates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33805 name: 2-amino-2-deoxy-D-gluconate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:33808 name: galacturonic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33809 name: digalacturonic acid is_a: CHEBI:33808 ! galacturonic acids is_a: CHEBI:35317 ! glycosylgalactose [Term] id: CHEBI:3381 name: (-)-car-3-ene subset: chebi_ph7_3 is_a: CHEBI:35661 ! car-3-ene [Term] id: CHEBI:33812 name: galacturonates is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:33820 name: iduronate is_a: CHEBI:24768 ! iduronates [Term] id: CHEBI:33821 name: mannuronate is_a: CHEBI:25175 ! mannuronates [Term] id: CHEBI:33822 name: organic hydroxy compound is_a: CHEBI:24651 ! hydroxides is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:33823 name: enol subset: chebi_ph7_3 is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:33828 name: xylonic acid is_a: CHEBI:33753 ! pentonic acid [Term] id: CHEBI:33830 name: galacturonic acid is_a: CHEBI:33808 ! galacturonic acids relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:33832 name: organic cyclic compound is_a: CHEBI:33595 ! cyclic compound is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:33833 name: heteroarene is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:33835 name: anthrone subset: chebi_ph7_3 is_a: CHEBI:146281 ! anthracenone relationship: has_role CHEBI:48578 ! radical scavenger [Term] id: CHEBI:33836 name: benzenoid aromatic compound is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:33837 name: conjugated protein is_a: CHEBI:36080 ! protein [Term] id: CHEBI:33838 name: nucleoside subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:26912 ! oxolanes is_a: CHEBI:61120 ! nucleobase-containing molecular entity [Term] id: CHEBI:33839 name: macromolecule is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:33842 name: aromatic annulene is_a: CHEBI:33662 ! annulene is_a: CHEBI:33847 ! monocyclic arene [Term] id: CHEBI:33843 name: arabinonic acid derivative is_a: CHEBI:63454 ! pentonic acid derivative [Term] id: CHEBI:33845 name: xylonic acid derivative is_a: CHEBI:63454 ! pentonic acid derivative [Term] id: CHEBI:33847 name: monocyclic arene is_a: CHEBI:33658 ! arene [Term] id: CHEBI:33848 name: polycyclic arene is_a: CHEBI:33658 ! arene is_a: CHEBI:33666 ! polycyclic hydrocarbon relationship: has_role CHEBI:138015 ! endocrine disruptor relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:33853 name: phenols subset: chebi_ph7_3 is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:33854 name: aromatic alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:33855 name: arenecarbaldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:33856 name: aromatic amino acid is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:33857 name: aromatic primary alcohol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33854 ! aromatic alcohol [Term] id: CHEBI:33859 name: aromatic carboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:33860 name: aromatic amine is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:33861 name: transition element coordination entity is_a: CHEBI:33240 ! coordination entity is_a: CHEBI:33497 ! transition element molecular entity [Term] id: CHEBI:33862 name: platinum coordination entity is_a: CHEBI:33749 ! platinum molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:33864 name: gulonates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33865 name: rhamnonates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33866 name: mannonates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33867 name: idonates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33868 name: altronates is_a: CHEBI:33760 ! hexonate [Term] id: CHEBI:33869 name: ribonates is_a: CHEBI:33761 ! pentonate [Term] id: CHEBI:33871 name: glycerate subset: chebi_ph7_3 is_a: CHEBI:24347 ! glycerates is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:33883 name: fructuronic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33885 name: alpha-D-galacturonic acid is_a: CHEBI:4153 ! D-galactopyranuronic acid [Term] id: CHEBI:33886 name: glucuronic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33888 name: cobalt molecular entity is_a: CHEBI:33767 ! cobalt group molecular entity relationship: has_part CHEBI:27638 ! cobalt atom [Term] id: CHEBI:33890 name: cobalt coordination entity is_a: CHEBI:33861 ! transition element coordination entity is_a: CHEBI:33888 ! cobalt molecular entity [Term] id: CHEBI:33892 name: iron coordination entity is_a: CHEBI:24873 ! iron molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:33893 name: reagent is_a: CHEBI:33232 ! application [Term] id: CHEBI:33897 name: iduronic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33898 name: mannuronic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33899 name: tagaturonic acids is_a: CHEBI:24592 ! hexuronic acid [Term] id: CHEBI:33900 name: tagaturonate is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:33901 name: fructuronates is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:33903 name: glucuronates is_a: CHEBI:24591 ! hexuronate [Term] id: CHEBI:33905 name: heptose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:33906 name: cobalt corrinoid is_a: CHEBI:33890 ! cobalt coordination entity is_a: CHEBI:33909 ! metallotetrapyrrole is_a: CHEBI:33913 ! corrinoid [Term] id: CHEBI:33907 name: cob(III)yrinic acid is_a: CHEBI:23389 ! cobalt-corrinoid heptacarboxylic acid is_a: CHEBI:52500 ! cobyrinic acid [Term] id: CHEBI:33909 name: metallotetrapyrrole is_a: CHEBI:36309 ! cyclic tetrapyrrole [Term] id: CHEBI:3391 name: carbazole is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:38180 ! polycyclic heteroarene is_a: CHEBI:48513 ! carbazoles [Term] id: CHEBI:33913 name: corrinoid subset: chebi_ph7_3 is_a: CHEBI:36309 ! cyclic tetrapyrrole relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:33914 name: aldotriose is_a: CHEBI:15693 ! aldose is_a: CHEBI:27137 ! triose [Term] id: CHEBI:33915 name: aldotetrose is_a: CHEBI:15693 ! aldose is_a: CHEBI:26938 ! tetrose [Term] id: CHEBI:33916 name: aldopentose is_a: CHEBI:15693 ! aldose is_a: CHEBI:25901 ! pentose [Term] id: CHEBI:33917 name: aldohexose is_a: CHEBI:15693 ! aldose is_a: CHEBI:18133 ! hexose [Term] id: CHEBI:3392 name: carbendazim subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:87036 ! benzimidazole fungicide is_a: CHEBI:87064 ! benzimidazolylcarbamate fungicide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35444 ! antinematodal drug relationship: has_role CHEBI:61951 ! microtubule-destabilising agent relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:33920 name: ketoaldose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:33921 name: ketoaldohexose is_a: CHEBI:18133 ! hexose is_a: CHEBI:33920 ! ketoaldose [Term] id: CHEBI:33922 name: sugar dianhydride is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:33926 name: dialdose is_a: CHEBI:35381 ! monosaccharide [Term] id: CHEBI:33937 name: macronutrient is_a: CHEBI:33284 ! nutrient [Term] id: CHEBI:33942 name: ribose is_a: CHEBI:33916 ! aldopentose [Term] id: CHEBI:33946 name: erythrose is_a: CHEBI:23957 ! erythroses [Term] id: CHEBI:33947 name: threose is_a: CHEBI:26992 ! threoses [Term] id: CHEBI:33949 name: ketoheptose is_a: CHEBI:24978 ! ketose is_a: CHEBI:33905 ! heptose [Term] id: CHEBI:33951 name: psicose is_a: CHEBI:24973 ! ketohexose [Term] id: CHEBI:33952 name: sorbose derivative is_a: CHEBI:63401 ! ketooctose derivative [Term] id: CHEBI:33953 name: tagatose derivative is_a: CHEBI:63391 ! ketohexose derivative [Term] id: CHEBI:33954 name: tagatose is_a: CHEBI:24973 ! ketohexose [Term] id: CHEBI:33956 name: ribulose derivative is_a: CHEBI:63405 ! ketopentose derivative [Term] id: CHEBI:33957 name: xylulose derivative is_a: CHEBI:63405 ! ketopentose derivative [Term] id: CHEBI:33958 name: halide salt is_a: CHEBI:24866 ! salt is_a: CHEBI:37578 ! halide relationship: has_part CHEBI:16042 ! halide anion [Term] id: CHEBI:33964 name: silver molecular entity is_a: CHEBI:33745 ! copper group molecular entity relationship: has_part CHEBI:30512 ! silver atom [Term] id: CHEBI:33966 name: elemental silver is_a: CHEBI:33964 ! silver molecular entity [Term] id: CHEBI:33969 name: gold molecular entity is_a: CHEBI:33745 ! copper group molecular entity relationship: has_part CHEBI:29287 ! gold atom [Term] id: CHEBI:33970 name: elemental gold is_a: CHEBI:33969 ! gold molecular entity [Term] id: CHEBI:33973 name: elemental magnesium is_a: CHEBI:25108 ! magnesium molecular entity [Term] id: CHEBI:33976 name: magnesium coordination entity is_a: CHEBI:25108 ! magnesium molecular entity is_a: CHEBI:35217 ! alkaline earth coordination entity [Term] id: CHEBI:33980 name: quinovose is_a: CHEBI:23623 ! deoxyglucose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:33983 name: deoxymannose is_a: CHEBI:23628 ! deoxyhexose [Term] id: CHEBI:33984 name: fucose is_a: CHEBI:18133 ! hexose is_a: CHEBI:23622 ! deoxygalactose [Term] id: CHEBI:33985 name: muramates is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:33986 name: muramate is_a: CHEBI:33985 ! muramates [Term] id: CHEBI:33992 name: (-)-catechin subset: chebi_ph7_3 is_a: CHEBI:23053 ! catechin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:34002 name: (3S)-3-Hydroxyadipyl-CoA is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:34008 name: (R)-3-hydroxy-3-methyl-2-oxopentanoic acid is_a: CHEBI:28710 ! 3-hydroxy-3-methyl-2-oxopentanoic acid [Term] id: CHEBI:34047 name: 1,2-dihydrostilbene subset: chebi_ph7_3 is_a: CHEBI:51571 ! diphenylethane [Term] id: CHEBI:34063 name: naphthalene-1,4-diol subset: chebi_ph7_3 is_a: CHEBI:38133 ! naphthalenediol is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:34071 name: 1-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75612 ! 1-arachidonoylglycerol [Term] id: CHEBI:34080 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoglycerol is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:34083 name: \{1-hexadecanoyl-2-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}ethanolamine is_a: CHEBI:16038 ! phosphatidylethanolamine [Term] id: CHEBI:34086 name: \{1-O-hexadecanoyl-2-O-[(Z)-octadec-9-enoyl]-sn-glycero-3-phospho}serine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:340863 name: 2-phospholactic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:34115 name: 1-O-hexadecyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:15850 ! 1-O-alkyl-sn-glycerol is_a: CHEBI:76061 ! 1-O-palmitylglycerol [Term] id: CHEBI:34116 name: (9Z)-1-O-octadec-9-enyl glycerol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:34117 name: batilol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:34126 name: 11(R)-HETE is_a: CHEBI:72606 ! 11-HETE [Term] id: CHEBI:34127 name: 11(R)-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34130 name: 11,12-EET is_a: CHEBI:64007 ! EET relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:34133 name: 11-oxotestosterone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:34144 name: 12(R)-HETE is_a: CHEBI:84447 ! (5Z,8Z,10E,14Z)-12-hydroxyicosatetraenoic acid [Term] id: CHEBI:34145 name: 12(R)-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34146 name: 12(S)-HETE is_a: CHEBI:36275 ! HETE is_a: CHEBI:84447 ! (5Z,8Z,10E,14Z)-12-hydroxyicosatetraenoic acid relationship: has_role CHEBI:72571 ! pro-angiogenic agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:34151 name: 12-oxo-ETE is_a: CHEBI:61704 ! oxoicosatetraenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34154 name: 13(S)-HODE is_a: CHEBI:36328 ! HODE relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:34157 name: 14,15-EET is_a: CHEBI:64007 ! EET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34159 name: 15-deoxy-Delta(12,14)-prostaglandin J2 is_a: CHEBI:26346 ! prostaglandins J relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50864 ! insulin-sensitizing drug relationship: has_role CHEBI:59739 ! electrophilic reagent [Term] id: CHEBI:34162 name: 16(R)-HETE is_a: CHEBI:63994 ! 16-HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34172 name: 16alpha-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:23824 ! diol is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen [Term] id: CHEBI:34227 name: 2,3-di-O-phytanyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:37812 ! dialkylglycerol [Term] id: CHEBI:34238 name: 2,4-dibromophenol subset: chebi_ph7_3 is_a: CHEBI:172368 ! brominated flame retardant is_a: CHEBI:33624 ! bromophenol is_a: CHEBI:37147 ! dibromobenzene relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:3424 name: carnitinium is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:34306 name: 20-HETE is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:34310 name: (24S)-24-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:50515 ! 24-hydroxycholesterol relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:34311 name: 27-O-demethylrifamycin SV is_a: CHEBI:24995 ! lactam is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:26580 ! rifamycins is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:59779 ! cyclic ketal relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:34317 name: 3,3',4,4',5-pentachlorobiphenyl subset: chebi_ph7_3 is_a: CHEBI:27096 ! trichlorobenzene is_a: CHEBI:36721 ! pentachlorobiphenyl [Term] id: CHEBI:34342 name: 3-methylcholanthrene subset: chebi_ph7_3 is_a: CHEBI:35300 ! ortho- and peri-fused polycyclic arene relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:72768 ! aryl hydrocarbon receptor agonist [Term] id: CHEBI:34368 name: stilbene-4,4'-diol subset: chebi_ph7_3 is_a: CHEBI:36027 ! stilbenol [Term] id: CHEBI:34450 name: 5,6-EET is_a: CHEBI:64007 ! EET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34477 name: 6beta-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:34483 name: 7-hydroxyflavanone subset: chebi_ph7_3 is_a: CHEBI:38748 ! monohydroxyflavanone [Term] id: CHEBI:34485 name: 8(R)-HPODE is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:36329 ! HPODE [Term] id: CHEBI:34487 name: 8(S)-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34490 name: 8,9-EET is_a: CHEBI:64007 ! EET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34494 name: 9(10)-EpOME is_a: CHEBI:72659 ! epoxyoctadecenoic acid [Term] id: CHEBI:34496 name: 9(S)-HODE is_a: CHEBI:72651 ! 9-HODE [Term] id: CHEBI:34497 name: 9(S)-HPETE is_a: CHEBI:78732 ! 9-HPETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:34498 name: 9(S)-HPODE is_a: CHEBI:36329 ! HPODE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:34528 name: adipoyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:34584 name: boldenone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:50786 ! anabolic androgenic steroid is_a: CHEBI:77166 ! 3-oxo-Delta(1),Delta(4)-steroid [Term] id: CHEBI:34596 name: (3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-beta-caroten-12'-al subset: chebi_ph7_3 is_a: CHEBI:37602 ! allenes is_a: CHEBI:51972 ! 12'-apo-carotenal [Term] id: CHEBI:34597 name: (3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-beta-caroten-12'-al subset: chebi_ph7_3 is_a: CHEBI:51972 ! 12'-apo-carotenal [Term] id: CHEBI:34656 name: cumene subset: chebi_ph7_3 is_a: CHEBI:38976 ! alkylbenzene [Term] id: CHEBI:34687 name: dibutyl phthalate subset: chebi_ph7_3 is_a: CHEBI:35484 ! phthalate ester is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:67239 ! EC 3.2.1.20 (alpha-glucosidase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:79056 ! plasticiser [Term] id: CHEBI:34718 name: 1-chloro-2,4-dinitrobenzene subset: chebi_ph7_3 is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:139492 ! sensitiser relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:34768 name: furfural subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24129 ! furans relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:77523 ! Maillard reaction product [Term] id: CHEBI:34779 name: glyoxal subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde relationship: has_role CHEBI:25944 ! pesticide relationship: has_role CHEBI:26155 ! plant growth regulator relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:34784 name: hepoxilin B3 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36200 ! hepoxilin is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:34787 name: heptanal subset: chebi_ph7_3 is_a: CHEBI:12834 ! n-alkanal is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:142621 ! medium-chain fatty aldehyde relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:34848 name: mevastatin subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:75885 ! 2-pyranones is_a: CHEBI:87632 ! statin (naturally occurring) relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite relationship: has_role CHEBI:77255 ! EC 3.4.24.83 (anthrax lethal factor endopeptidase) inhibitor [Term] id: CHEBI:34862 name: N-(30-(9Z,12Z-octadecadienoyloxy)-tricontanoyl)-sphing-4-enine subset: chebi_ph7_3 is_a: CHEBI:144785 ! omega-linoleoyloxy-O-ultra-long chain acylceramide is_a: CHEBI:157662 ! N-(omega-linoleoyloxy-ultra-long chain fatty acyl)sphingosine is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:34892 name: nocodazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:26961 ! thiophenes is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:60832 ! tubulin modulator relationship: has_role CHEBI:61951 ! microtubule-destabilising agent relationship: has_role CHEBI:64911 ! antimitotic [Term] id: CHEBI:34905 name: paraquat subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:24527 ! herbicide [Term] id: CHEBI:34907 name: paxilline subset: chebi_ph7_3 is_a: CHEBI:23847 ! diterpene alkaloid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51689 ! enone is_a: CHEBI:51914 ! organic heterohexacyclic compound is_a: CHEBI:65321 ! terpenoid indole alkaloid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:50509 ! potassium channel blocker relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:60186 ! EC 3.6.3.8 (Ca(2+)-transporting ATPase) inhibitor relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:34911 name: permethrin subset: chebi_ph7_3 is_a: CHEBI:50351 ! cyclopropanecarboxylate ester is_a: CHEBI:51454 ! cyclopropanes relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:38956 ! ectoparasiticide relationship: has_role CHEBI:39116 ! pyrethroid ester insecticide relationship: has_role CHEBI:39259 ! pyrethroid ester acaricide relationship: has_role CHEBI:73333 ! scabicide [Term] id: CHEBI:34939 name: prostaglandin D3 is_a: CHEBI:26337 ! prostaglandins D relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35008 name: tetralin subset: chebi_ph7_3 is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon is_a: CHEBI:36786 ! tetralins [Term] id: CHEBI:35020 name: tributyrin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:50477 ! butyrate ester relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50267 ! protective agent relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:35026 name: triethylamine is_a: CHEBI:32876 ! tertiary amine [Term] id: CHEBI:35032 name: trioxilin B3 is_a: CHEBI:36201 ! trioxilin [Term] id: CHEBI:350546 name: serotonin(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35063 name: alpha-zeacarotene subset: chebi_ph7_3 is_a: CHEBI:139115 ! carotenoid epsilon-end derivative is_a: CHEBI:35163 ! cyclic carotene [Term] id: CHEBI:35106 name: nitrogen hydride is_a: CHEBI:35881 ! pnictogen hydride is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:35107 name: azane is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:35113 name: elemental mercury is_a: CHEBI:25196 ! mercury molecular entity [Term] id: CHEBI:35114 name: 3-isopropylmalic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:35115 name: elemental manganese is_a: CHEBI:25154 ! manganese molecular entity [Term] id: CHEBI:35121 name: (2R,3S)-3-isopropylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:15592 ! 3-isopropylmalate(2-) is_a: CHEBI:167114 ! 2-hydroxydicarboxylate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:35128 name: (2S)-2-isopropylmalic acid is_a: CHEBI:28635 ! 2-isopropylmalic acid [Term] id: CHEBI:35131 name: aldose phosphate is_a: CHEBI:33447 ! phospho sugar [Term] id: CHEBI:35132 name: ketose phosphate is_a: CHEBI:33447 ! phospho sugar [Term] id: CHEBI:35133 name: ketoheptose phosphate is_a: CHEBI:35132 ! ketose phosphate [Term] id: CHEBI:35134 name: metalloprotein is_a: CHEBI:33837 ! conjugated protein [Term] id: CHEBI:35135 name: iron-sulfur protein is_a: CHEBI:35136 ! iron protein relationship: has_part CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:35136 name: iron protein is_a: CHEBI:35134 ! metalloprotein [Term] id: CHEBI:35137 name: hemoprotein is_a: CHEBI:35136 ! iron protein relationship: has_part CHEBI:30413 ! heme [Term] id: CHEBI:35138 name: aldotetrose phosphate is_a: CHEBI:35131 ! aldose phosphate [Term] id: CHEBI:35139 name: uronic acid phosphate is_a: CHEBI:33447 ! phospho sugar [Term] id: CHEBI:35142 name: aldotriose phosphate is_a: CHEBI:35131 ! aldose phosphate [Term] id: CHEBI:35143 name: hemoglobin is_a: CHEBI:5386 ! globin [Term] id: CHEBI:35145 name: D-glucuronic acid 1-phosphate is_a: CHEBI:35139 ! uronic acid phosphate [Term] id: CHEBI:35146 name: (S)-3-methyl-2-oxovalerate subset: chebi_ph7_3 is_a: CHEBI:28654 ! 3-methyl-2-oxovalerate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:35147 name: (6'R)-beta,epsilon-carotene subset: chebi_ph7_3 is_a: CHEBI:28425 ! alpha-carotene [Term] id: CHEBI:35148 name: (6'S)-beta,epsilon-carotene subset: chebi_ph7_3 is_a: CHEBI:28425 ! alpha-carotene [Term] id: CHEBI:35155 name: elemental calcium is_a: CHEBI:22985 ! calcium molecular entity [Term] id: CHEBI:35157 name: aldoheptose phosphate is_a: CHEBI:35131 ! aldose phosphate [Term] id: CHEBI:35158 name: ribose bisphosphate is_a: CHEBI:26562 ! ribose phosphate [Term] id: CHEBI:35159 name: ribose monophosphate is_a: CHEBI:26562 ! ribose phosphate [Term] id: CHEBI:35160 name: phosphomethylribose is_a: CHEBI:26562 ! ribose phosphate [Term] id: CHEBI:35161 name: deoxyketopentose phosphate is_a: CHEBI:63351 ! deoxyketopentose derivative [Term] id: CHEBI:35162 name: acyclic carotene is_a: CHEBI:23042 ! carotene [Term] id: CHEBI:35163 name: cyclic carotene is_a: CHEBI:23042 ! carotene [Term] id: CHEBI:35164 name: 2,4'-dihydroxyacetophenone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:23776 ! dihydroxyacetophenone is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:35166 name: vanadium coordination entity is_a: CHEBI:27275 ! vanadium molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:35168 name: hydrogenvanadate is_a: CHEBI:30528 ! vanadium oxoanion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:35169 name: dihydrogenvanadate subset: chebi_ph7_3 is_a: CHEBI:30528 ! vanadium oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:35171 name: elemental vanadium is_a: CHEBI:27275 ! vanadium molecular entity [Term] id: CHEBI:35172 name: vanadium cation subset: chebi_ph7_3 is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:35171 ! elemental vanadium relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:35173 name: 2-dehydro-3-deoxy-L-arabinonate subset: chebi_ph7_3 is_a: CHEBI:24961 ! ketoaldonate [Term] id: CHEBI:35177 name: 2-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:35179 name: 2-oxo monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35181 name: 4-amino-4-deoxychorismate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:35184 name: gluconic acid phosphate is_a: CHEBI:22300 ! aldonic acid phosphate [Term] id: CHEBI:35186 name: terpene is_a: CHEBI:24632 ! hydrocarbon is_a: CHEBI:24913 ! isoprenoid [Term] id: CHEBI:35187 name: monoterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35188 name: hemiterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35189 name: sesquiterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35190 name: diterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35191 name: triterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35192 name: sesterterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35193 name: tetraterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:35194 name: isoprene subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:33646 ! alkadiene is_a: CHEBI:35188 ! hemiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:35195 name: surfactant is_a: CHEBI:63046 ! emulsifier [Term] id: CHEBI:35196 name: nitrogen oxide is_a: CHEBI:24836 ! inorganic oxide is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:35202 name: molybdenum coordination entity is_a: CHEBI:25370 ! molybdenum molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:35203 name: molybdopterins is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester is_a: CHEBI:63169 ! pyranopterin [Term] id: CHEBI:35204 name: tracer is_a: CHEBI:33232 ! application relationship: has_part CHEBI:35209 ! label [Term] id: CHEBI:35209 name: label is_a: CHEBI:33232 ! application [Term] id: CHEBI:35213 name: cyclodepsipeptide is_a: CHEBI:23643 ! depsipeptide is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:35217 name: alkaline earth coordination entity is_a: CHEBI:33299 ! alkaline earth molecular entity is_a: CHEBI:36562 ! main-group coordination entity [Term] id: CHEBI:35218 name: anthocyanin cation is_a: CHEBI:24400 ! glycoside is_a: CHEBI:47916 ! flavonoid is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:35219 name: plant growth retardant is_a: CHEBI:26155 ! plant growth regulator [Term] id: CHEBI:35221 name: antimetabolite is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:35222 name: inhibitor is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:35223 name: catalyst is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:35224 name: effector is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:35227 name: 4-nitrotoluene subset: chebi_ph7_3 is_a: CHEBI:63171 ! mononitrotoluene [Term] id: CHEBI:3523 name: cellodextrin subset: chebi_ph7_3 is_a: CHEBI:28675 ! dextrin is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:35230 name: fossil fuel is_a: CHEBI:33292 ! fuel [Term] id: CHEBI:35233 name: tungsten coordination entity is_a: CHEBI:33742 ! tungsten molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:35235 name: L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35237 ! cysteine zwitterion [Term] id: CHEBI:35236 name: D-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35237 ! cysteine zwitterion [Term] id: CHEBI:35237 name: cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:35238 name: amino acid zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:35239 name: ADP-sugar is_a: CHEBI:64711 ! purine nucleotide-sugar [Term] id: CHEBI:35240 name: nucleotide-alditol is_a: CHEBI:35241 ! nucleotide-carbohydrate [Term] id: CHEBI:35241 name: nucleotide-carbohydrate is_a: CHEBI:47784 ! nucleotide conjugate is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:35242 name: CDP-D-glucose is_a: CHEBI:20873 ! CDP-sugar [Term] id: CHEBI:35243 name: serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:35244 name: nucleotide-oligosaccharide is_a: CHEBI:35241 ! nucleotide-carbohydrate [Term] id: CHEBI:35245 name: GDP-galactose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:35247 name: D-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35243 ! serine zwitterion [Term] id: CHEBI:35248 name: dTDP-D-glucose is_a: CHEBI:15700 ! dTDP-alpha-D-glucose [Term] id: CHEBI:35251 name: dTDP-mannose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:35252 name: dTDP-L-mannose is_a: CHEBI:35251 ! dTDP-mannose [Term] id: CHEBI:35253 name: dTDP-talose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:35254 name: dTDP-L-talose is_a: CHEBI:35253 ! dTDP-talose [Term] id: CHEBI:35256 name: nucleotide-glycopeptide is_a: CHEBI:16670 ! peptide [Term] id: CHEBI:35257 name: UDP-glycopeptide is_a: CHEBI:35256 ! nucleotide-glycopeptide [Term] id: CHEBI:35258 name: glyco-amino acid is_a: CHEBI:33709 ! amino acid is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:35259 name: benzofurans is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:35262 name: UDP-amino sugar is_a: CHEBI:17297 ! UDP-sugar is_a: CHEBI:28963 ! amino sugar [Term] id: CHEBI:35265 name: N-phospho-D-lombricine is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:35266 name: L-2-succinylamino-6-oxoheptanedioic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:35267 name: quaternary ammonium ion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:35269 name: N-glycosyl amino acid is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35258 ! glyco-amino acid [Term] id: CHEBI:35272 name: O-glycosyl amino acid is_a: CHEBI:35258 ! glyco-amino acid [Term] id: CHEBI:35274 name: ammonium ion derivative is_a: CHEBI:33702 ! polyatomic cation is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:35275 name: S-glycosyl compound is_a: CHEBI:59793 ! monothioacetal is_a: CHEBI:63161 ! glycosyl compound is_a: CHEBI:63299 ! carbohydrate derivative is_a: CHEBI:73754 ! thiosugar [Term] id: CHEBI:3528 name: cellotriose subset: chebi_ph7_3 is_a: CHEBI:146180 ! glucotriose relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:35280 name: L-proline betaine subset: chebi_ph7_3 is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:22860 ! amino-acid betaine relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:35281 name: onium betaine is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:35282 name: sulfonium betaine is_a: CHEBI:26830 ! sulfonium compound is_a: CHEBI:35281 ! onium betaine [Term] id: CHEBI:35284 name: ammonium betaine is_a: CHEBI:26469 ! quaternary nitrogen compound is_a: CHEBI:35281 ! onium betaine [Term] id: CHEBI:35285 name: iminium betaine is_a: CHEBI:26469 ! quaternary nitrogen compound is_a: CHEBI:35281 ! onium betaine [Term] id: CHEBI:35286 name: iminium ion is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:35287 name: acylcholine subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:35288 name: all-trans-violaxanthin subset: chebi_ph7_3 is_a: CHEBI:27295 ! violaxanthin relationship: has_role CHEBI:77182 ! food colouring [Term] id: CHEBI:35290 name: 1,2-dichlorobenzene subset: chebi_ph7_3 is_a: CHEBI:23697 ! dichlorobenzene relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50908 ! hepatotoxic agent [Term] id: CHEBI:35291 name: all-trans-retinoate subset: chebi_ph7_3 is_a: CHEBI:15036 ! retinoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35293 name: fused compound is_a: CHEBI:33635 ! polycyclic compound [Term] id: CHEBI:35294 name: carbopolycyclic compound is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:35295 ! homopolycyclic compound [Term] id: CHEBI:35295 name: homopolycyclic compound is_a: CHEBI:33597 ! homocyclic compound is_a: CHEBI:33635 ! polycyclic compound [Term] id: CHEBI:35296 name: ortho-fused polycyclic arene is_a: CHEBI:33848 ! polycyclic arene is_a: CHEBI:35427 ! ortho-fused polycyclic hydrocarbon [Term] id: CHEBI:35297 name: acene subset: chebi_ph7_3 is_a: CHEBI:35296 ! ortho-fused polycyclic arene is_a: CHEBI:51269 ! acenes [Term] id: CHEBI:35300 name: ortho- and peri-fused polycyclic arene is_a: CHEBI:33639 ! ortho- and peri-fused compound is_a: CHEBI:33848 ! polycyclic arene [Term] id: CHEBI:35305 name: 9-cis-violaxanthin subset: chebi_ph7_3 is_a: CHEBI:27295 ! violaxanthin is_a: CHEBI:51973 ! 9-cis-epoxycarotenoid [Term] id: CHEBI:35306 name: 9'-cis-neoxanthin subset: chebi_ph7_3 is_a: CHEBI:25501 ! neoxanthin is_a: CHEBI:51973 ! 9-cis-epoxycarotenoid [Term] id: CHEBI:35307 name: epoxycarotenol is_a: CHEBI:23043 ! epoxycarotenoid is_a: CHEBI:23045 ! carotenol [Term] id: CHEBI:35310 name: carotenone is_a: CHEBI:27325 ! xanthophyll [Term] id: CHEBI:35311 name: carotenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27325 ! xanthophyll [Term] id: CHEBI:35312 name: pentoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:35313 name: hexoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:35314 name: glycosiduronic acid is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:35315 name: deoxy hexoside is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:35317 name: glycosylgalactose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:35318 name: glycosylmannose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:35323 name: N-substituted amine is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:35324 name: hydrazinium(1+) is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:35325 name: hydrazinium(2+) is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:35328 name: spirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:35329 ! carotenoid ether relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:35329 name: carotenoid ether is_a: CHEBI:25698 ! ether is_a: CHEBI:27325 ! xanthophyll [Term] id: CHEBI:35330 name: spheroidene subset: chebi_ph7_3 is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:35331 name: rhodopin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:35333 name: 4-(4-deoxy-D-gluc-4-enosyluronic acid)-D-galacturonic acid is_a: CHEBI:33808 ! galacturonic acids [Term] id: CHEBI:35337 name: central nervous system stimulant is_a: CHEBI:35470 ! central nervous system drug [Term] id: CHEBI:35338 name: amphetamines is_a: CHEBI:32952 ! amine relationship: has_role CHEBI:35337 ! central nervous system stimulant [Term] id: CHEBI:35341 name: steroid subset: chebi_ph7_3 is_a: CHEBI:18059 ! lipid is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:35342 name: 17alpha-hydroxy steroid is_a: CHEBI:36838 ! 17-hydroxy steroid [Term] id: CHEBI:35343 name: 17beta-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:36838 ! 17-hydroxy steroid [Term] id: CHEBI:35344 name: 21-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:35346 name: 11beta-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:36841 ! 11-hydroxy steroid [Term] id: CHEBI:35347 name: 3alpha-sterol is_a: CHEBI:15889 ! sterol is_a: CHEBI:36835 ! 3alpha-hydroxy steroid [Term] id: CHEBI:35348 name: 3beta-sterol subset: chebi_ph7_3 is_a: CHEBI:15889 ! sterol is_a: CHEBI:36836 ! 3beta-hydroxy steroid [Term] id: CHEBI:35349 name: 7beta-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:36844 ! 7-hydroxy steroid [Term] id: CHEBI:35350 name: hydroxy steroid is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:35352 name: organonitrogen compound is_a: CHEBI:33285 ! heteroorganic entity is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:35353 name: isocyanide is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:35356 name: dicarboximide subset: chebi_ph7_3 is_a: CHEBI:24782 ! imide [Term] id: CHEBI:35358 name: sulfonamide subset: chebi_ph7_3 is_a: CHEBI:33256 ! primary amide is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:33552 ! sulfonic acid derivative [Term] id: CHEBI:35359 name: carboxamidine is_a: CHEBI:2634 ! amidine is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:35366 name: fatty acid is_a: CHEBI:18059 ! lipid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:35367 name: thiocarboxylic acid anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:35368 name: hexasaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:35369 name: pentasaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:35371 name: lipooligosaccharide is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:35372 name: D-fuconate subset: chebi_ph7_3 is_a: CHEBI:24115 ! fuconate [Term] id: CHEBI:35373 name: D-glucosaminide is_a: CHEBI:24587 ! hexosaminide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:35374 name: D-mannose 1-phosphate is_a: CHEBI:21060 ! mannose phosphate relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:35375 name: alditol 6-phosphate is_a: CHEBI:22297 ! alditol phosphate [Term] id: CHEBI:35378 name: glycosylfructose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:35381 name: monosaccharide is_a: CHEBI:16646 ! carbohydrate [Term] id: CHEBI:35384 name: idarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:48870 ! idaric acid anion [Term] id: CHEBI:35385 name: idarate(2-) is_a: CHEBI:48870 ! idaric acid anion [Term] id: CHEBI:35386 name: D-idarate(1-) is_a: CHEBI:35384 ! idarate(1-) [Term] id: CHEBI:35387 name: L-idarate(1-) is_a: CHEBI:35384 ! idarate(1-) [Term] id: CHEBI:35389 name: altrarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:48916 ! altraric acid anion [Term] id: CHEBI:35390 name: galactarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:48871 ! galactaric acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35391 name: aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:132943 ! aspartate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:35392 name: glucarate(1-) is_a: CHEBI:48914 ! glucaric acid anion [Term] id: CHEBI:35397 name: tartrate(1-) is_a: CHEBI:48929 ! 3-carboxy-2,3-dihydroxypropanoate [Term] id: CHEBI:35398 name: L-tartrate(1-) is_a: CHEBI:35397 ! tartrate(1-) [Term] id: CHEBI:35399 name: D-tartrate(1-) is_a: CHEBI:35397 ! tartrate(1-) [Term] id: CHEBI:35400 name: meso-tartrate(1-) is_a: CHEBI:48929 ! 3-carboxy-2,3-dihydroxypropanoate [Term] id: CHEBI:35401 name: chromium oxoacid is_a: CHEBI:35403 ! chromium coordination entity is_a: CHEBI:36265 ! transition element oxoacid [Term] id: CHEBI:35402 name: chromium oxoanion is_a: CHEBI:35403 ! chromium coordination entity is_a: CHEBI:35405 ! transition element oxoanion [Term] id: CHEBI:35403 name: chromium coordination entity is_a: CHEBI:23237 ! chromium molecular entity is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:35404 name: chromate(2-) subset: chebi_ph7_3 is_a: CHEBI:35402 ! chromium oxoanion is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:63248 ! oxidising agent [Term] id: CHEBI:35405 name: transition element oxoanion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:33861 ! transition element coordination entity is_a: CHEBI:35406 ! oxoanion [Term] id: CHEBI:35406 name: oxoanion is_a: CHEBI:25741 ! oxide is_a: CHEBI:33273 ! polyatomic anion [Term] id: CHEBI:35410 name: primary diamine is_a: CHEBI:23666 ! diamine [Term] id: CHEBI:35411 name: alkane-alpha,omega-diamine is_a: CHEBI:35410 ! primary diamine is_a: CHEBI:46687 ! diazaalkane [Term] id: CHEBI:35412 name: aminal is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:35414 name: N-monoacetylalkane-alpha,omega-diamine is_a: CHEBI:22160 ! acetamides is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:35415 name: alpha-amino-acid residue cation is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:35416 name: alpha-amino-acid residue anion is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:35417 name: alpha-amino-acid residue radical is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:35418 name: N-acetylneuraminate subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35420 name: pregnenolone sulfate is_a: CHEBI:16158 ! steroid sulfate relationship: has_role CHEBI:77194 ! EC 2.7.1.33 (pantothenate kinase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35421 name: lithocholic acid sulfate is_a: CHEBI:16158 ! steroid sulfate [Term] id: CHEBI:35423 name: L-arabinose 1-phosphate is_a: CHEBI:22600 ! arabinose phosphate [Term] id: CHEBI:35425 name: D-ribose 1-phosphate is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:35426 name: ortho-fused bicyclic arene is_a: CHEBI:35296 ! ortho-fused polycyclic arene is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon [Term] id: CHEBI:35427 name: ortho-fused polycyclic hydrocarbon is_a: CHEBI:33637 ! ortho-fused compound [Term] id: CHEBI:35428 name: ortho-fused bicyclic hydrocarbon is_a: CHEBI:33637 ! ortho-fused compound is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:3543 name: cephamycin C is_a: CHEBI:55429 ! cephamycin [Term] id: CHEBI:35436 name: D-glucoside subset: chebi_ph7_3 is_a: CHEBI:24278 ! glucoside [Term] id: CHEBI:35438 name: nickel coordination entity is_a: CHEBI:33748 ! nickel molecular entity [Term] id: CHEBI:35440 name: (1R,2S)-3-phenylcyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:15599 ! cis-3-phenylcyclohexa-3,5-diene-1,2-diol [Term] id: CHEBI:35441 name: antiinfective agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35442 name: antiparasitic agent is_a: CHEBI:35441 ! antiinfective agent [Term] id: CHEBI:35443 name: anthelminthic drug is_a: CHEBI:35442 ! antiparasitic agent [Term] id: CHEBI:35444 name: antinematodal drug is_a: CHEBI:25491 ! nematicide is_a: CHEBI:35443 ! anthelminthic drug [Term] id: CHEBI:35446 name: chlorobiphenyl is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:36686 ! chloroarene [Term] id: CHEBI:35452 name: dTDP-L-rhamnose is_a: CHEBI:61119 ! dTDP-rhamnose relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35453 name: 5-dehydro-4-deoxy-D-glucarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:35457 name: EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor is_a: CHEBI:35674 ! antihypertensive agent is_a: CHEBI:76782 ! EC 3.4.15.* (peptidyl-dipeptidase) inhibitor [Term] id: CHEBI:35464 name: (Z)-hexadec-11-enoic acid is_a: CHEBI:24548 ! hexadecenoic acid [Term] id: CHEBI:35465 name: (Z)-hexadec-7-enoic acid is_a: CHEBI:24548 ! hexadecenoic acid [Term] id: CHEBI:35467 name: phosphorodiamide is_a: CHEBI:17102 ! phosphoramide [Term] id: CHEBI:35468 name: triazene subset: chebi_ph7_3 is_a: CHEBI:35106 ! nitrogen hydride [Term] id: CHEBI:35469 name: antidepressant is_a: CHEBI:35471 ! psychotropic drug [Term] id: CHEBI:35470 name: central nervous system drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35471 name: psychotropic drug is_a: CHEBI:35470 ! central nervous system drug [Term] id: CHEBI:35472 name: anti-inflammatory drug is_a: CHEBI:23888 ! drug is_a: CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:35473 name: tranquilizing drug is_a: CHEBI:35471 ! psychotropic drug is_a: CHEBI:35488 ! central nervous system depressant [Term] id: CHEBI:35474 name: anxiolytic drug is_a: CHEBI:35473 ! tranquilizing drug [Term] id: CHEBI:35475 name: non-steroidal anti-inflammatory drug is_a: CHEBI:35472 ! anti-inflammatory drug is_a: CHEBI:35842 ! antirheumatic drug [Term] id: CHEBI:35476 name: antipsychotic agent is_a: CHEBI:35473 ! tranquilizing drug [Term] id: CHEBI:35479 name: alkali metal salt is_a: CHEBI:24866 ! salt is_a: CHEBI:33296 ! alkali metal molecular entity [Term] id: CHEBI:35480 name: analgesic is_a: CHEBI:23888 ! drug is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:35481 name: non-narcotic analgesic is_a: CHEBI:35480 ! analgesic [Term] id: CHEBI:35482 name: opioid analgesic is_a: CHEBI:35480 ! analgesic [Term] id: CHEBI:35484 name: phthalate ester is_a: CHEBI:131927 ! dicarboxylic acids and O-substituted derivatives is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:62732 ! aromatic ester relationship: has_role CHEBI:138015 ! endocrine disruptor [Term] id: CHEBI:35486 name: maleate ester is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:35487 name: EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor is_a: CHEBI:76852 ! EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:35488 name: central nervous system depressant is_a: CHEBI:35470 ! central nervous system drug [Term] id: CHEBI:35489 name: organic disulfide subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:48343 ! disulfide [Term] id: CHEBI:35490 name: trypanothione disulfide is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:35491 name: L-cystine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35492 ! cystine zwitterion [Term] id: CHEBI:35492 name: cystine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35493 name: antipyretic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35494 name: D-cystine is_a: CHEBI:17376 ! cystine relationship: has_role CHEBI:145814 ! EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitor [Term] id: CHEBI:35496 name: fluorobenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:35497 name: androgen antagonist is_a: CHEBI:49020 ! hormone antagonist [Term] id: CHEBI:35498 name: diuretic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:354984 name: candicidin is_a: CHEBI:60004 ! mixture is_a: CHEBI:87113 ! antibiotic antifungal drug relationship: has_part CHEBI:3349 ! candicidin D relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:35499 name: hallucinogen is_a: CHEBI:35471 ! psychotropic drug [Term] id: CHEBI:35500 name: 1,4-benzodiazepinone is_a: CHEBI:22720 ! benzodiazepine [Term] id: CHEBI:35504 name: addition compound is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:35505 name: hydrate is_a: CHEBI:35504 ! addition compound relationship: has_part CHEBI:15377 ! water [Term] id: CHEBI:35506 name: alkaloid fundamental parent is_a: CHEBI:35507 ! natural product fundamental parent [Term] id: CHEBI:35507 name: natural product fundamental parent is_a: CHEBI:33245 ! organic fundamental parent [Term] id: CHEBI:35508 name: steroid fundamental parent is_a: CHEBI:35341 ! steroid is_a: CHEBI:35507 ! natural product fundamental parent [Term] id: CHEBI:35509 name: androstane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:35512 name: ergostane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:35515 name: 5alpha-cholestane subset: chebi_ph7_3 is_a: CHEBI:35516 ! cholestane [Term] id: CHEBI:35516 name: cholestane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:35517 name: 5beta-cholestane subset: chebi_ph7_3 is_a: CHEBI:35516 ! cholestane [Term] id: CHEBI:35518 name: campestane subset: chebi_ph7_3 is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:35519 name: cholane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:35522 name: beta-adrenergic agonist is_a: CHEBI:37886 ! adrenergic agonist is_a: CHEBI:48540 ! beta-adrenergic drug [Term] id: CHEBI:35523 name: bronchodilator agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35524 name: sympathomimetic agent is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:35526 name: hypoglycemic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35530 name: beta-adrenergic antagonist is_a: CHEBI:37887 ! adrenergic antagonist is_a: CHEBI:48540 ! beta-adrenergic drug [Term] id: CHEBI:35544 name: EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor is_a: CHEBI:76840 ! EC 1.14.99.* (miscellaneous oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:35545 name: bipyridine is_a: CHEBI:50511 ! bipyridines [Term] id: CHEBI:35550 name: 1H-1,2,4-triazole subset: chebi_ph7_3 is_a: CHEBI:35560 ! 1,2,4-triazole [Term] id: CHEBI:35552 name: heterocyclic organic fundamental parent is_a: CHEBI:33245 ! organic fundamental parent [Term] id: CHEBI:35554 name: cardiovascular drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35555 name: mancude organic heteromonocyclic parent is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:35571 ! mancude organic heterocyclic parent [Term] id: CHEBI:35556 name: pyrrole is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:35557 name: 3H-pyrrole is_a: CHEBI:35556 ! pyrrole [Term] id: CHEBI:35558 name: 2H-pyrrole is_a: CHEBI:35556 ! pyrrole [Term] id: CHEBI:35559 name: furan subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50908 ! hepatotoxic agent relationship: has_role CHEBI:77523 ! Maillard reaction product [Term] id: CHEBI:35560 name: 1,2,4-triazole is_a: CHEBI:38597 ! triazole [Term] id: CHEBI:35561 name: 3H-1,2,4-triazole subset: chebi_ph7_3 is_a: CHEBI:35560 ! 1,2,4-triazole [Term] id: CHEBI:35568 name: mancude ring is_a: CHEBI:23367 ! molecular entity [Term] id: CHEBI:35569 name: alpha-adrenergic agonist is_a: CHEBI:37886 ! adrenergic agonist is_a: CHEBI:48539 ! alpha-adrenergic drug [Term] id: CHEBI:35570 name: mancude organic heterobicyclic parent is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:35571 ! mancude organic heterocyclic parent [Term] id: CHEBI:35571 name: mancude organic heterocyclic parent is_a: CHEBI:35552 ! heterocyclic organic fundamental parent is_a: CHEBI:35573 ! organic mancude parent [Term] id: CHEBI:35573 name: organic mancude parent is_a: CHEBI:33245 ! organic fundamental parent is_a: CHEBI:35568 ! mancude ring [Term] id: CHEBI:35579 name: 3H-indole subset: chebi_ph7_3 is_a: CHEBI:35581 ! indole [Term] id: CHEBI:35580 name: N-oxide is_a: CHEBI:25741 ! oxide [Term] id: CHEBI:35581 name: indole is_a: CHEBI:24828 ! indoles is_a: CHEBI:35570 ! mancude organic heterobicyclic parent is_a: CHEBI:52362 ! ortho-fused heteroarene relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35584 name: purine is_a: CHEBI:26401 ! purines is_a: CHEBI:35570 ! mancude organic heterobicyclic parent relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:35586 name: 1H-purine is_a: CHEBI:35584 ! purine [Term] id: CHEBI:35588 name: 3H-purine is_a: CHEBI:35584 ! purine [Term] id: CHEBI:35589 name: 9H-purine subset: chebi_ph7_3 is_a: CHEBI:35584 ! purine [Term] id: CHEBI:35592 name: 2H-pyran subset: chebi_ph7_3 is_a: CHEBI:35594 ! pyran [Term] id: CHEBI:35593 name: 4H-pyran subset: chebi_ph7_3 is_a: CHEBI:35594 ! pyran [Term] id: CHEBI:35594 name: pyran is_a: CHEBI:26407 ! pyrans is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent [Term] id: CHEBI:35596 name: (+)-pulegone subset: chebi_ph7_3 is_a: CHEBI:26381 ! p-menth-4(8)-en-3-one [Term] id: CHEBI:35601 name: 2H-chromene subset: chebi_ph7_3 is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:35602 ! chromene [Term] id: CHEBI:356010 name: 5-aminopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:35602 name: chromene is_a: CHEBI:23232 ! chromenes is_a: CHEBI:35570 ! mancude organic heterobicyclic parent [Term] id: CHEBI:35603 name: 4H-chromene subset: chebi_ph7_3 is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:35602 ! chromene [Term] id: CHEBI:35604 name: carbon oxoanion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:35406 ! oxoanion is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:35605 name: carbon oxoacid is_a: CHEBI:24833 ! oxoacid is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:35608 name: EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor is_a: CHEBI:76775 ! EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor [Term] id: CHEBI:35610 name: antineoplastic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35615 name: tropane is_a: CHEBI:35506 ! alkaloid fundamental parent is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:38295 ! azabicycloalkane is_a: CHEBI:38419 ! saturated organic heterobicyclic parent [Term] id: CHEBI:35616 name: trans-anethole subset: chebi_ph7_3 is_a: CHEBI:2716 ! anethole relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:35617 name: flavouring agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:35618 name: aromatic ether is_a: CHEBI:25698 ! ether is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:35619 name: L-alpha-aminobutyric acid is_a: CHEBI:35621 ! alpha-aminobutyric acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35620 name: vasodilator agent is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:35621 name: alpha-aminobutyric acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35622 name: thiazolidines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:35623 name: anticonvulsant is_a: CHEBI:35488 ! central nervous system depressant [Term] id: CHEBI:35624 name: azaspiro compound is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:35625 name: EC 3.5.2.6 (beta-lactamase) inhibitor is_a: CHEBI:76808 ! EC 3.5.2.* (non-peptide cyclic amide C-N hydrolase) inhibitor [Term] id: CHEBI:35627 name: beta-lactam subset: chebi_ph7_3 is_a: CHEBI:24995 ! lactam [Term] id: CHEBI:35640 name: adrenergic uptake inhibitor is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:356416 name: 5-ammoniolevulinate subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:35643 name: aporphine is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:38515 ! isoquinoline alkaloid fundamental parent is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:356445 name: glycylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35649 name: morphinan is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:38515 ! isoquinoline alkaloid fundamental parent [Term] id: CHEBI:35660 name: HIV protease inhibitor is_a: CHEBI:37670 ! protease inhibitor is_a: CHEBI:64946 ! anti-HIV agent [Term] id: CHEBI:35661 name: car-3-ene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene [Term] id: CHEBI:35662 name: terpenoid fundamental parent is_a: CHEBI:35507 ! natural product fundamental parent [Term] id: CHEBI:35663 name: carane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:35664 name: EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:35666 name: thiopurine is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:26401 ! purines [Term] id: CHEBI:35673 name: abietane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:35674 name: antihypertensive agent is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:35676 name: benzazepine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:35679 name: antilipemic drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35680 name: abietate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:36762 ! abietane diterpenoid [Term] id: CHEBI:35681 name: secondary alcohol subset: chebi_ph7_3 is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:35683 name: aryl sulfide is_a: CHEBI:16385 ! organic sulfide [Term] id: CHEBI:35684 name: antiplatyhelmintic drug is_a: CHEBI:35443 ! anthelminthic drug [Term] id: CHEBI:35688 name: benzimidazolecarboxylic acid is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:35689 name: tetrazoles is_a: CHEBI:68452 ! azole [Term] id: CHEBI:35690 name: cyclobutane-1,1-dicarboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:36205 ! cyclobutanedicarboxylate [Term] id: CHEBI:35691 name: cyclobutane-1,1-dicarboxylic acid is_a: CHEBI:36186 ! cyclobutanedicarboxylic acid [Term] id: CHEBI:35692 name: dicarboxylic acid is_a: CHEBI:131927 ! dicarboxylic acids and O-substituted derivatives is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:35693 name: dicarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35694 name: cyclobutane-1,1-dicarboxylate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:35695 name: dicarboxylic acid monoanion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:35697 name: trans-cinnamic acid is_a: CHEBI:27386 ! cinnamic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:35701 name: ester is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:35703 name: xenobiotic is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:35704 name: N(2)-acetyl-L-lysine is_a: CHEBI:22193 ! acetyl-L-lysine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35705 name: immunosuppressive agent is_a: CHEBI:50846 ! immunomodulator [Term] id: CHEBI:35709 name: thujane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:35710 name: pinane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:35711 name: ursane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:35713 name: polycyclic alkane is_a: CHEBI:33666 ! polycyclic hydrocarbon [Term] id: CHEBI:35714 name: polycyclic olefin is_a: CHEBI:33642 ! cyclic olefin is_a: CHEBI:33666 ! polycyclic hydrocarbon [Term] id: CHEBI:35715 name: nitro compound is_a: CHEBI:51143 ! nitrogen molecular entity relationship: has_part CHEBI:29785 ! nitro group [Term] id: CHEBI:35716 name: C-nitro compound is_a: CHEBI:35715 ! nitro compound is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:35717 name: sedative is_a: CHEBI:35488 ! central nervous system depressant [Term] id: CHEBI:35718 name: antifungal agent is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:35719 name: sulfamic acids is_a: CHEBI:33552 ! sulfonic acid derivative [Term] id: CHEBI:35721 name: heparan sulfates is_a: CHEBI:24500 ! heparan is_a: CHEBI:35722 ! sulfated glycosaminoglycan [Term] id: CHEBI:35722 name: sulfated glycosaminoglycan is_a: CHEBI:18085 ! glycosaminoglycan is_a: CHEBI:35724 ! carbohydrate sulfate [Term] id: CHEBI:35724 name: carbohydrate sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:35725 name: isopropyl ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:35727 name: triazoles is_a: CHEBI:68452 ! azole [Term] id: CHEBI:35735 name: dicarboxylic acid monoamide is_a: CHEBI:23690 ! dicarboxylic acid amide [Term] id: CHEBI:35737 name: monothiocarboxylic acid is_a: CHEBI:33307 ! thiocarboxylic acid [Term] id: CHEBI:35740 name: liposaccharide is_a: CHEBI:18059 ! lipid is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:35741 name: glycerolipid is_a: CHEBI:18059 ! lipid [Term] id: CHEBI:35742 name: tetracarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:35743 name: pentacarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:35744 name: carbocyclic fatty acid is_a: CHEBI:59238 ! cyclic fatty acid [Term] id: CHEBI:35746 name: fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:59768 ! aliphatic aldehyde [Term] id: CHEBI:35748 name: fatty acid ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:35753 name: tricarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35754 name: tetracarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35755 name: pentacarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35757 name: monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35759 name: 1-monoglyceride subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:76575 ! monoradylglycerol [Term] id: CHEBI:3576 name: chanoclavine-I is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38111 ! benzoindole is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:35766 name: glycerophosphoserine is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:35771 name: glycerophosphoinositol phosphate is_a: CHEBI:36315 ! glycerophosphoinositol [Term] id: CHEBI:35774 name: CDP-glycerols is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:35776 name: arsenic oxoanion is_a: CHEBI:22632 ! arsenic molecular entity is_a: CHEBI:33459 ! pnictogen oxoanion [Term] id: CHEBI:35779 name: dicarboxylic acid diamide is_a: CHEBI:23690 ! dicarboxylic acid amide [Term] id: CHEBI:35780 name: phosphate ion is_a: CHEBI:33461 ! phosphorus oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35782 name: diphosphate ion is_a: CHEBI:33461 ! phosphorus oxoanion [Term] id: CHEBI:35783 name: bornane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:35785 name: sphingoid is_a: CHEBI:26739 ! sphingolipid [Term] id: CHEBI:35786 name: phosphosphingolipid is_a: CHEBI:16247 ! phospholipid is_a: CHEBI:26739 ! sphingolipid [Term] id: CHEBI:35788 name: seco-steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:35789 name: oxo steroid is_a: CHEBI:17087 ! ketone is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:35790 name: oxazole is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:68452 ! azole [Term] id: CHEBI:35794 name: tetrapyrrole fundamental parent is_a: CHEBI:26932 ! tetrapyrrole is_a: CHEBI:35507 ! natural product fundamental parent [Term] id: CHEBI:35795 name: polyprenylbenzoquinone is_a: CHEBI:132124 ! 1,4-benzoquinones is_a: CHEBI:26255 ! prenylquinone [Term] id: CHEBI:35800 name: nitroso compound is_a: CHEBI:51143 ! nitrogen molecular entity relationship: has_part CHEBI:35801 ! nitroso group [Term] id: CHEBI:35801 name: nitroso group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group is_a: CHEBI:51144 ! nitrogen group [Term] id: CHEBI:35802 name: 3-carboxy-2-(carboxymethyl)-2-hydroxypropanoate is_a: CHEBI:35804 ! citrate(1-) [Term] id: CHEBI:35804 name: citrate(1-) is_a: CHEBI:133748 ! citrate anion is_a: CHEBI:36299 ! tricarboxylic acid monoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:35806 name: 3,4-dicarboxy-3-hydroxybutanoate is_a: CHEBI:35804 ! citrate(1-) [Term] id: CHEBI:35808 name: citrate(2-) is_a: CHEBI:133748 ! citrate anion is_a: CHEBI:36300 ! tricarboxylic acid dianion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:35809 name: 2-(carboxymethyl)-2-hydroxysuccinate is_a: CHEBI:35808 ! citrate(2-) [Term] id: CHEBI:35810 name: 3-carboxy-3-hydroxypentanedioate is_a: CHEBI:35808 ! citrate(2-) [Term] id: CHEBI:35811 name: 2-endo-hydroxy-1,8-cineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole [Term] id: CHEBI:35812 name: oxfendazole subset: chebi_ph7_3 is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester relationship: has_role CHEBI:35444 ! antinematodal drug [Term] id: CHEBI:35816 name: leprostatic drug is_a: CHEBI:64912 ! antimycobacterial drug [Term] id: CHEBI:35818 name: coccidiostat is_a: CHEBI:35820 ! antiprotozoal drug [Term] id: CHEBI:35819 name: branched-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:35820 name: antiprotozoal drug is_a: CHEBI:35442 ! antiparasitic agent is_a: CHEBI:36043 ! antimicrobial drug [Term] id: CHEBI:35821 name: anticholesteremic drug is_a: CHEBI:35679 ! antilipemic drug [Term] id: CHEBI:35825 name: mandelic acid is_a: CHEBI:22712 ! benzenes is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:35842 name: antirheumatic drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:35850 name: sulfone is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:35856 name: lipoxygenase inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:35862 name: bacitracin A is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:24613 ! homodetic cyclic peptide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:35865 name: 5alpha-cholest-7-ene subset: chebi_ph7_3 is_a: CHEBI:23178 ! cholest-7-ene [Term] id: CHEBI:35868 name: hydroxy monocarboxylic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:35871 name: oxo monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25754 ! oxo carboxylic acid [Term] id: CHEBI:35873 name: carboxylic anhydride is_a: CHEBI:36586 ! carbonyl compound is_a: CHEBI:36606 ! acid anhydride [Term] id: CHEBI:35875 name: imidazopyrimidine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:33833 ! heteroarene is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:35881 name: pnictogen hydride is_a: CHEBI:33242 ! inorganic hydride is_a: CHEBI:33302 ! pnictogen molecular entity [Term] id: CHEBI:35897 name: but-3-enoic acid is_a: CHEBI:22959 ! butenoic acid [Term] id: CHEBI:35899 name: crotonate subset: chebi_ph7_3 is_a: CHEBI:36258 ! but-2-enoate [Term] id: CHEBI:35900 name: but-3-enoate subset: chebi_ph7_3 is_a: CHEBI:36029 ! butenoate [Term] id: CHEBI:35902 name: oxo monocarboxylic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:35903 ! oxo carboxylic acid anion [Term] id: CHEBI:35903 name: oxo carboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:35907 name: glutarate(1-) is_a: CHEBI:24329 ! glutarate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35908 name: glutaramate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:35910 name: 2-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35915 name: sterol ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:47880 ! steroid ester [Term] id: CHEBI:35923 name: hydroperoxide is_a: CHEBI:24651 ! hydroxides relationship: has_part CHEBI:29792 ! hydroperoxy group [Term] id: CHEBI:35924 name: peroxol subset: chebi_ph7_3 is_a: CHEBI:35923 ! hydroperoxide is_a: CHEBI:36963 ! organooxygen compound is_a: CHEBI:37863 ! chalcoperoxol [Term] id: CHEBI:35931 name: delta-amino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:35932 name: 3-methyl-2-oxovaleric acid is_a: CHEBI:191197 ! branched-chain keto acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35935 name: pent-4-enoate subset: chebi_ph7_3 is_a: CHEBI:36030 ! pentenoate [Term] id: CHEBI:35936 name: pent-4-enoic acid is_a: CHEBI:25897 ! pentenoic acid [Term] id: CHEBI:35940 name: protirelin subset: chebi_ph7_3 is_a: CHEBI:25905 ! peptide hormone is_a: CHEBI:47923 ! tripeptide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:35941 name: serotonergic agonist is_a: CHEBI:48278 ! serotonergic drug [Term] id: CHEBI:35942 name: neurotransmitter agent is_a: CHEBI:23888 ! drug is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:35950 name: 4-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35951 name: dioxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35952 name: 5-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35958 name: epsilon-amino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:35960 name: 6-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35962 name: sorbic acid is_a: CHEBI:24555 ! hexadienoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:35964 name: penta-2,4-dienoic acid is_a: CHEBI:25876 ! pentadienoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:35969 name: 3-hydroxy monocarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:35970 name: 4-hydroxy monocarboxylic acid is_a: CHEBI:13611 ! 4-hydroxy carboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:35971 name: 6-hydroxy monocarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:35972 name: dihydroxy monocarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:35973 name: 3-oxo monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35974 name: 4-oxo monocarboxylic acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35975 name: 5-oxo monocarboxylic acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35976 name: 6-oxo monocarboxylic acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35979 name: dioxo monocarboxylic acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35983 name: 7-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:35984 name: 7-oxo monocarboxylic acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:35986 name: nonan-1-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:195604 ! nonanol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:35987 name: diamino acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:35990 name: bridged compound is_a: CHEBI:33635 ! polycyclic compound [Term] id: CHEBI:35992 name: penams is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:27933 ! beta-lactam antibiotic is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:35998 name: tridecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36003 name: decenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:36004 name: tetradecenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:36005 name: docosahexaenoic acid is_a: CHEBI:132544 ! fatty acid 22:6 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36006 name: icosapentaenoic acid is_a: CHEBI:132540 ! fatty acid 20:5 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:36007 name: trans-stilbene subset: chebi_ph7_3 is_a: CHEBI:26775 ! stilbene [Term] id: CHEBI:36009 name: omega-6 fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59549 ! essential fatty acid [Term] id: CHEBI:36011 name: pinosylvin subset: chebi_ph7_3 is_a: CHEBI:36027 ! stilbenol [Term] id: CHEBI:36014 name: chloromethane subset: chebi_ph7_3 is_a: CHEBI:23148 ! chloromethanes is_a: CHEBI:25253 ! methyl halides relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:36016 name: chloroethanes is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:23128 ! chloroalkane [Term] id: CHEBI:36021 name: octadec-9-enoic acid is_a: CHEBI:25634 ! octadecenoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36022 name: octadec-6-enoic acid is_a: CHEBI:25634 ! octadecenoic acid [Term] id: CHEBI:36023 name: vaccenic acid is_a: CHEBI:25634 ! octadecenoic acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:36024 name: trideca-2,6-dienoic acid is_a: CHEBI:27105 ! tridecadienoic acid [Term] id: CHEBI:36025 name: octadeca-9,11-dienoic acid is_a: CHEBI:61159 ! conjugated linoleic acid [Term] id: CHEBI:36027 name: stilbenol is_a: CHEBI:26776 ! stilbenoid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:36029 name: butenoate is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:58951 ! short-chain fatty acid anion [Term] id: CHEBI:36030 name: pentenoate is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion [Term] id: CHEBI:36031 name: docosenoic acid is_a: CHEBI:132541 ! fatty acid 22:1 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:36032 name: tetracosenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:36033 name: icosatetraenoic acid is_a: CHEBI:132539 ! fatty acid 20:4 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:36035 name: icosa-5,8,11,13-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36036 name: fatty acid 20:3 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:36037 name: (5Z,9E,14Z)-icosa-5,9,14-trienoic acid is_a: CHEBI:36036 ! fatty acid 20:3 [Term] id: CHEBI:36038 name: icosa-7,9,11,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36039 name: icosa-5,8,10,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36040 name: icosa-6,8,11,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36042 name: icosa-5,9,11,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36043 name: antimicrobial drug is_a: CHEBI:33281 ! antimicrobial agent is_a: CHEBI:35441 ! antiinfective agent [Term] id: CHEBI:36044 name: antiviral drug is_a: CHEBI:22587 ! antiviral agent is_a: CHEBI:36043 ! antimicrobial drug [Term] id: CHEBI:36045 name: icosa-6,8,10,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36046 name: icosatetraenedioic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid [Term] id: CHEBI:36047 name: antibacterial drug is_a: CHEBI:33282 ! antibacterial agent is_a: CHEBI:36043 ! antimicrobial drug [Term] id: CHEBI:36054 name: benzoate ester is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:62732 ! aromatic ester [Term] id: CHEBI:36055 name: furoic acid is_a: CHEBI:24129 ! furans is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:36056 name: furancarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36059 name: hydroxy monocarboxylic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36061 name: octa-2,4-dienoate is_a: CHEBI:25637 ! octadienoate [Term] id: CHEBI:36062 name: 3,4-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:132365 ! EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:77484 ! EC 1.1.1.25 (shikimate dehydrogenase) inhibitor [Term] id: CHEBI:36063 name: oxytocic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:36064 name: taxane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36066 name: prostaglandins Falpha subset: chebi_ph7_3 is_a: CHEBI:26340 ! prostaglandins F [Term] id: CHEBI:36078 name: cholanoid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:36080 name: protein is_a: CHEBI:33695 ! information biomacromolecule relationship: has_part CHEBI:16541 ! protein polypeptide chain [Term] id: CHEBI:36084 name: dihydroxybenzoate is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:36085 name: trihydroxybenzoate is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:36086 name: sulfonatobenzoate is_a: CHEBI:22713 ! arenesulfonate oxoanion is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:36087 name: cinnamate ester is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:36088 name: thromboxanes A subset: chebi_ph7_3 is_a: CHEBI:26995 ! thromboxane [Term] id: CHEBI:36090 name: 4-coumaric acid is_a: CHEBI:23401 ! coumaric acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36091 name: cinnamates is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36094 name: organic chloride salt is_a: CHEBI:23114 ! chloride salt is_a: CHEBI:51069 ! organic halide salt [Term] id: CHEBI:36096 name: cyclohexanecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:36100 name: (S)-isoflavan subset: chebi_ph7_3 is_a: CHEBI:38740 ! isoflavan [Term] id: CHEBI:36101 name: (R)-isoflavan subset: chebi_ph7_3 is_a: CHEBI:38740 ! isoflavan [Term] id: CHEBI:36102 name: (2R)-flavan subset: chebi_ph7_3 is_a: CHEBI:38691 ! flavan [Term] id: CHEBI:36103 name: (2S)-flavan subset: chebi_ph7_3 is_a: CHEBI:38691 ! flavan [Term] id: CHEBI:36104 name: 1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid [Term] id: CHEBI:36105 name: (2R)-flavanone subset: chebi_ph7_3 is_a: CHEBI:5070 ! flavanone [Term] id: CHEBI:36106 name: 2-naphthoic acid is_a: CHEBI:25483 ! naphthoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:36107 name: 2-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:36108 name: 1-hydroxy-2-naphthoic acid is_a: CHEBI:25392 ! naphthols is_a: CHEBI:25483 ! naphthoic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:36109 name: piperidinecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36110 name: pipecolate is_a: CHEBI:36109 ! piperidinecarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36112 name: pyridinedicarboxylic acid is_a: CHEBI:26421 ! pyridines is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36114 name: chromenylium subset: chebi_ph7_3 is_a: CHEBI:72704 ! chromenyliums [Term] id: CHEBI:36115 name: 1H-isochromene subset: chebi_ph7_3 is_a: CHEBI:36117 ! isochromene [Term] id: CHEBI:36116 name: 3H-isochromene subset: chebi_ph7_3 is_a: CHEBI:36117 ! isochromene [Term] id: CHEBI:36117 name: isochromene is_a: CHEBI:35570 ! mancude organic heterobicyclic parent is_a: CHEBI:38761 ! isochromenes [Term] id: CHEBI:36121 name: flavylium subset: chebi_ph7_3 is_a: CHEBI:72704 ! chromenyliums [Term] id: CHEBI:36123 name: cyclitol carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:36124 name: (+)-quinic acid is_a: CHEBI:26493 ! quinic acid [Term] id: CHEBI:36125 name: cyclitol carboxylic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36126 name: cyclohexenecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36128 name: cyclopropanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36129 name: pentenedioic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36130 name: cyclic terpene ketone is_a: CHEBI:26872 ! terpene ketone is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:36132 name: alicyclic ketone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:36133 name: pentenedioate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36134 name: glutaconate(2-) subset: chebi_ph7_3 is_a: CHEBI:36133 ! pentenedioate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36140 name: cyclopentanones is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:36141 name: quinone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:36144 name: ferriheme b subset: chebi_ph7_3 is_a: CHEBI:26355 ! heme b is_a: CHEBI:38574 ! ferriheme [Term] id: CHEBI:36145 name: oxo dicarboxylic acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36147 name: oxo dicarboxylate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36148 name: 4-hydroxy-2-oxoglutarate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:36149 name: 2-hydroxyglutarate(1-) is_a: CHEBI:132941 ! 2-hydroxyglutarate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:36157 name: muconate subset: chebi_ph7_3 is_a: CHEBI:24552 ! hexadienedioate [Term] id: CHEBI:36158 name: metalloprotoporphyrin is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:26361 ! protoporphyrins [Term] id: CHEBI:36159 name: protoporphyrinate is_a: CHEBI:26361 ! protoporphyrins relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36164 name: amino dicarboxylic acid is_a: CHEBI:33709 ! amino acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36165 name: pimelate(2-) subset: chebi_ph7_3 is_a: CHEBI:133773 ! pimelate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36166 name: 5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36167 name: dipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:36173 ! pyridinedicarboxylate [Term] id: CHEBI:36173 name: pyridinedicarboxylate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36174 name: octenedioic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36175 name: octenedioate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36178 name: cytoporphyrins is_a: CHEBI:26214 ! porphyrins [Term] id: CHEBI:36180 name: butenedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:36181 name: succinate ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:36186 name: cyclobutanedicarboxylic acid is_a: CHEBI:156473 ! cyclobutanes is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36188 name: malate ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:36190 name: hepoxilin A3 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36200 ! hepoxilin is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:36191 name: hexenedioate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36192 name: 2-hexenedioic acid is_a: CHEBI:25789 ! hexenedioic acid [Term] id: CHEBI:36194 name: cyclohexadienedicarboxylic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:36197 name: pyrandicarboxylic acid is_a: CHEBI:26407 ! pyrans is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:36200 name: hepoxilin is_a: CHEBI:36036 ! fatty acid 20:3 [Term] id: CHEBI:36201 name: trioxilin is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:36202 name: all-cis-icosa-5,8,14-trienoic acid is_a: CHEBI:36036 ! fatty acid 20:3 [Term] id: CHEBI:36203 name: trioxilin A3 is_a: CHEBI:36201 ! trioxilin [Term] id: CHEBI:36204 name: 12-hydroxylaurate subset: chebi_ph7_3 is_a: CHEBI:194241 ! omega-hydroxy-medium-chain fatty acid anion [Term] id: CHEBI:36205 name: cyclobutanedicarboxylate is_a: CHEBI:156473 ! cyclobutanes is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:36206 name: 3-hydroxylauric acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:36208 name: shikimate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:36126 ! cyclohexenecarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:36210 name: (S)-3-hydroxylauric acid is_a: CHEBI:36206 ! 3-hydroxylauric acid [Term] id: CHEBI:36211 name: 2-hydroxydodecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid [Term] id: CHEBI:36218 name: beta-lactose subset: chebi_ph7_3 is_a: CHEBI:17716 ! lactose [Term] id: CHEBI:36219 name: alpha-lactose subset: chebi_ph7_3 is_a: CHEBI:17716 ! lactose [Term] id: CHEBI:36223 name: thiomorpholinemonocarboxylic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:36393 ! thiomorpholines is_a: CHEBI:46978 ! thiazinemonocarboxylic acid [Term] id: CHEBI:36232 name: icosa-5,7,11,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36233 name: disaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:36234 name: chenodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36235 name: bile acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:36237 name: cholanic acid is_a: CHEBI:36278 ! cholanic acids [Term] id: CHEBI:36238 name: 5beta-cholanic acid is_a: CHEBI:36237 ! cholanic acid is_a: CHEBI:36248 ! 5beta-cholanic acids [Term] id: CHEBI:36240 name: 3alpha,7alpha,12beta-trihydroxy-5beta-cholanic acid is_a: CHEBI:27114 ! trihydroxy-5beta-cholanic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36241 name: 3,4-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:36242 name: 3-(4-hydroxyphenyl)pyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36243 name: propanoate ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:36244 name: dicarboxylic acid monoester is_a: CHEBI:131927 ! dicarboxylic acids and O-substituted derivatives is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:36246 name: 5alpha-cholanic acids is_a: CHEBI:36278 ! cholanic acids [Term] id: CHEBI:36248 name: 5beta-cholanic acids is_a: CHEBI:136889 ! 5beta steroid is_a: CHEBI:36278 ! cholanic acids [Term] id: CHEBI:36249 name: bile acid conjugate is_a: CHEBI:36078 ! cholanoid [Term] id: CHEBI:36252 name: glycochenodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36255 name: bile acid glycine conjugate is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:36249 ! bile acid conjugate [Term] id: CHEBI:36257 name: taurocholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:33554 ! organosulfonate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36258 name: but-2-enoate subset: chebi_ph7_3 is_a: CHEBI:36029 ! butenoate [Term] id: CHEBI:36259 name: taurolithocholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36260 name: monohydroxy-5beta-cholanic acid is_a: CHEBI:24663 ! hydroxy-5beta-cholanic acid [Term] id: CHEBI:36261 name: taurodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36262 name: molybdenum oxoanion is_a: CHEBI:35202 ! molybdenum coordination entity is_a: CHEBI:35405 ! transition element oxoanion [Term] id: CHEBI:36263 name: hydrogenmolybdate is_a: CHEBI:36262 ! molybdenum oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:36264 name: molybdate subset: chebi_ph7_3 is_a: CHEBI:36262 ! molybdenum oxoanion is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:36265 name: transition element oxoacid is_a: CHEBI:33861 ! transition element coordination entity [Term] id: CHEBI:36267 name: molybdenum oxoacid is_a: CHEBI:35202 ! molybdenum coordination entity is_a: CHEBI:36265 ! transition element oxoacid [Term] id: CHEBI:36270 name: tungsten oxoanion is_a: CHEBI:35233 ! tungsten coordination entity is_a: CHEBI:35405 ! transition element oxoanion [Term] id: CHEBI:36271 name: hydrogentungstate is_a: CHEBI:36270 ! tungsten oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:36272 name: tungstic acid is_a: CHEBI:35233 ! tungsten coordination entity [Term] id: CHEBI:36274 name: glycochenodeoxycholic acid is_a: CHEBI:36255 ! bile acid glycine conjugate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36275 name: HETE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:36278 name: cholanic acids is_a: CHEBI:36078 ! cholanoid is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:36279 name: oct-2-enedioic acid is_a: CHEBI:36174 ! octenedioic acid [Term] id: CHEBI:36280 name: oct-2-enedioate is_a: CHEBI:36175 ! octenedioate [Term] id: CHEBI:36281 name: caffeic acid is_a: CHEBI:24689 ! hydroxycinnamic acid is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:64964 ! EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:76797 ! EC 2.5.1.18 (glutathione transferase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36299 name: tricarboxylic acid monoanion is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:36300 name: tricarboxylic acid dianion is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:36301 name: ferroheme o subset: chebi_ph7_3 is_a: CHEBI:24480 ! heme o is_a: CHEBI:38573 ! ferroheme [Term] id: CHEBI:36302 name: icosa-5,8,12,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36306 name: icosa-5,8,11,14-tetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:36307 name: glycosyl alditol is_a: CHEBI:17522 ! alditol [Term] id: CHEBI:36309 name: cyclic tetrapyrrole is_a: CHEBI:26932 ! tetrapyrrole is_a: CHEBI:47882 ! cyclic polypyrrole [Term] id: CHEBI:36310 name: glycosylglycerol phosphate is_a: CHEBI:26707 ! glycerol phosphate is_a: CHEBI:63425 ! galactosylglycerol derivative [Term] id: CHEBI:36311 name: corphinoid is_a: CHEBI:36309 ! cyclic tetrapyrrole [Term] id: CHEBI:36312 name: sarpagan is_a: CHEBI:38482 ! indole alkaloid fundamental parent is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:36313 name: glycerophosphocholine is_a: CHEBI:36700 ! phosphocholines is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:36314 name: glycerophosphoethanolamine is_a: CHEBI:36711 ! phosphoethanolamine is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:36315 name: glycerophosphoinositol is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:36316 name: dipyrrole is_a: CHEBI:38077 ! polypyrrole [Term] id: CHEBI:36321 name: porphyrinogens is_a: CHEBI:26214 ! porphyrins is_a: CHEBI:51389 ! calixpyrroles [Term] id: CHEBI:363227 name: 6alpha,20xi-murideoxycholic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid [Term] id: CHEBI:36326 name: octadecanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid [Term] id: CHEBI:36328 name: HODE is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:36329 name: HPODE is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:36326 ! octadecanoid [Term] id: CHEBI:36330 name: senecionan is_a: CHEBI:35506 ! alkaloid fundamental parent is_a: CHEBI:38521 ! pyrrolizine alkaloid [Term] id: CHEBI:36331 name: octadeca-10,12-dienoic acid is_a: CHEBI:61159 ! conjugated linoleic acid [Term] id: CHEBI:36333 name: local anaesthetic is_a: CHEBI:38867 ! anaesthetic [Term] id: CHEBI:36334 name: naphthalene-1,3,5-trisulfonic acid is_a: CHEBI:36336 ! naphthalenesulfonic acid [Term] id: CHEBI:36335 name: trypanocidal drug is_a: CHEBI:35820 ! antiprotozoal drug [Term] id: CHEBI:36336 name: naphthalenesulfonic acid is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:36338 name: lepton is_a: CHEBI:33233 ! fundamental particle is_a: CHEBI:36340 ! fermion [Term] id: CHEBI:36339 name: baryon is_a: CHEBI:36340 ! fermion is_a: CHEBI:36344 ! hadron [Term] id: CHEBI:36340 name: fermion is_a: CHEBI:36342 ! subatomic particle [Term] id: CHEBI:36341 name: boson is_a: CHEBI:36342 ! subatomic particle [Term] id: CHEBI:36342 name: subatomic particle [Term] id: CHEBI:36343 name: composite particle is_a: CHEBI:36342 ! subatomic particle [Term] id: CHEBI:36344 name: hadron is_a: CHEBI:36343 ! composite particle [Term] id: CHEBI:36347 name: nuclear particle is_a: CHEBI:36342 ! subatomic particle [Term] id: CHEBI:36357 name: polyatomic entity is_a: CHEBI:23367 ! molecular entity relationship: has_part CHEBI:24433 ! group [Term] id: CHEBI:36358 name: polyatomic ion is_a: CHEBI:24870 ! ion is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:36359 name: phosphorus oxoacid derivative is_a: CHEBI:33241 ! oxoacid derivative is_a: CHEBI:36360 ! phosphorus oxoacids and derivatives [Term] id: CHEBI:36360 name: phosphorus oxoacids and derivatives is_a: CHEBI:26082 ! phosphorus molecular entity [Term] id: CHEBI:36361 name: phosphorous acid subset: chebi_ph7_3 is_a: CHEBI:33457 ! phosphorus oxoacid [Term] id: CHEBI:36363 name: hydroxyphosphanone is_a: CHEBI:33457 ! phosphorus oxoacid [Term] id: CHEBI:3638 name: chloroquine is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:36709 ! aminoquinoline is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:35842 ! antirheumatic drug relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:88230 ! autophagy inhibitor [Term] id: CHEBI:36387 name: chloroalkene is_a: CHEBI:39482 ! chloroolefin is_a: CHEBI:5610 ! haloalkene [Term] id: CHEBI:36388 name: saturated organic heterocyclic parent is_a: CHEBI:35552 ! heterocyclic organic fundamental parent [Term] id: CHEBI:36389 name: saturated organic heteromonocyclic parent is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:36388 ! saturated organic heterocyclic parent [Term] id: CHEBI:36393 name: thiomorpholines is_a: CHEBI:46954 ! thiazinane [Term] id: CHEBI:36401 name: cycloalkadiene is_a: CHEBI:36403 ! monocyclic olefin [Term] id: CHEBI:36402 name: cycloalkatriene is_a: CHEBI:36403 ! monocyclic olefin [Term] id: CHEBI:36403 name: monocyclic olefin is_a: CHEBI:33642 ! cyclic olefin [Term] id: CHEBI:36404 name: cyclohexene subset: chebi_ph7_3 is_a: CHEBI:33643 ! cycloalkene [Term] id: CHEBI:36405 name: 2-aminohexanoic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:36408 name: 5-hydroxy-L-kynurenine is_a: CHEBI:2076 ! 5-hydroxykynurenine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:36413 name: anabolic agent is_a: CHEBI:24621 ! hormone [Term] id: CHEBI:36416 name: mancude organic heterotricyclic parent is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:35571 ! mancude organic heterocyclic parent [Term] id: CHEBI:36420 name: acridine subset: chebi_ph7_3 is_a: CHEBI:22213 ! acridines is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:38180 ! polycyclic heteroarene relationship: has_role CHEBI:50902 ! genotoxin [Term] id: CHEBI:36422 name: 3H-carbazole is_a: CHEBI:3391 ! carbazole [Term] id: CHEBI:36423 name: 1H-carbazole subset: chebi_ph7_3 is_a: CHEBI:3391 ! carbazole [Term] id: CHEBI:36424 name: 4aH-carbazole is_a: CHEBI:3391 ! carbazole [Term] id: CHEBI:36425 name: 8aH-carbazole subset: chebi_ph7_3 is_a: CHEBI:3391 ! carbazole [Term] id: CHEBI:36432 name: 2-methylbut-2-enoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:36434 name: octadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:36438 name: (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:36445 name: alkylglucosinolate is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:36451 name: alkenylglucosinolate is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:36452 name: aralkylglucosinolate is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:36453 name: isocitrate(2-) is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:36454 name: isocitrate(1-) is_a: CHEBI:36299 ! tricarboxylic acid monoanion [Term] id: CHEBI:36455 name: homoisocitrate(2-) is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:36456 name: homoisocitrate(1-) is_a: CHEBI:36299 ! tricarboxylic acid monoanion [Term] id: CHEBI:36457 name: homocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:36458 name: homocitrate(2-) is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:36459 name: homocitrate(1-) is_a: CHEBI:36299 ! tricarboxylic acid monoanion [Term] id: CHEBI:36460 name: (E)-glutaconate(2-) subset: chebi_ph7_3 is_a: CHEBI:36134 ! glutaconate(2-) [Term] id: CHEBI:36461 name: (E)-glutaconate(1-) is_a: CHEBI:36462 ! glutaconate(1-) [Term] id: CHEBI:36462 name: glutaconate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:36464 name: (R)-mevalonate subset: chebi_ph7_3 is_a: CHEBI:194520 ! 3,5-dihydroxy-3-methylpentanoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36465 name: cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylate is_a: CHEBI:17708 ! 1,6-dihydroxycyclohexa-2,4-dienecarboxylate [Term] id: CHEBI:36470 name: quinazoline alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:38530 ! quinazolines [Term] id: CHEBI:36473 name: gammacerane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36474 name: drimane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36475 name: 1-oleoylglycerone 3-phosphate is_a: CHEBI:15835 ! 1-acylglycerone 3-phosphate [Term] id: CHEBI:36476 name: 1-stearoylglycerone 3-phosphate is_a: CHEBI:15835 ! 1-acylglycerone 3-phosphate [Term] id: CHEBI:36477 name: sulfoglycosphingolipid is_a: CHEBI:26829 ! sulfoglycolipid is_a: CHEBI:36526 ! acidic glycosphingolipid [Term] id: CHEBI:36480 name: bisabolane subset: chebi_ph7_3 is_a: CHEBI:23453 ! cycloalkane is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36481 name: oleanane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36482 name: hopane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36483 name: protostane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36484 name: hopan-22-ol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51963 ! hopanoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36485 name: lupane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36486 name: 13-(beta-D-glucosyloxy)docosanoic acid is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:36487 name: 13-(beta-D-glucosyloxy)docosanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:36488 name: dammarane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35341 ! steroid is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36489 name: 17beta-estradiol 3-glucosiduronic acid is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36491 name: 2-methoxy-17beta-estradiol 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:36492 name: (+)-isomenthone subset: chebi_ph7_3 is_a: CHEBI:36493 ! isomenthone [Term] id: CHEBI:36493 name: isomenthone is_a: CHEBI:36742 ! p-menthan-3-one [Term] id: CHEBI:36496 name: (-)-isomenthone subset: chebi_ph7_3 is_a: CHEBI:36493 ! isomenthone [Term] id: CHEBI:36498 name: galactosylceramide subset: chebi_ph7_3 is_a: CHEBI:23079 ! cerebroside is_a: CHEBI:5254 ! galactolipid is_a: CHEBI:62941 ! glycosylceramide [Term] id: CHEBI:36500 name: glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:23079 ! cerebroside is_a: CHEBI:62941 ! glycosylceramide [Term] id: CHEBI:36501 name: (2Z,4Z)-5-carboxypenta-2,4-dienoate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:36503 name: menthone subset: chebi_ph7_3 is_a: CHEBI:36742 ! p-menthan-3-one [Term] id: CHEBI:36504 name: 5-carboxypenta-2,4-dienoate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:36505 name: labdane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36507 name: D-galactosyl-N-acetyl-D-glucosaminyl-D-galactosyl-D-glucosylceramide is_a: CHEBI:23075 ! glycotetraosylceramide [Term] id: CHEBI:36508 name: glycotriaosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:36513 name: cadinane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36514 name: germacrane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36515 name: (-)-germacrene A subset: chebi_ph7_3 is_a: CHEBI:36517 ! germacrene A [Term] id: CHEBI:36517 name: germacrene A subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36743 ! germacrene [Term] id: CHEBI:36520 name: oligoglycosylceramide is_a: CHEBI:17761 ! ceramide is_a: CHEBI:25513 ! neutral glycosphingolipid [Term] id: CHEBI:36521 name: eremophilane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36522 name: eudesmane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36523 name: humulane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36526 name: acidic glycosphingolipid is_a: CHEBI:24402 ! glycosphingolipid [Term] id: CHEBI:36527 name: glycosylsphingoid is_a: CHEBI:25513 ! neutral glycosphingolipid [Term] id: CHEBI:36528 name: alpha-Neup5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:75127 ! alpha-N-acetylneuraminyl-(2->3)-D-galactosyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36529 name: aristolochene is_a: CHEBI:136397 ! (2xi)-3-deoxy-7-O-phosphonato-beta-D-threo-hept-6-ulopyranosonate is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36530 name: cedrane subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36531 name: (2Z,4E)-5-carboxy-2,3,5-trichloropenta-2,4-dienoate is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:38427 ! 2,3,5-trichloro-cis,cis-muconate(1-) [Term] id: CHEBI:36534 name: 2,6,10-trimethyldodeca-2,6,10-triene subset: chebi_ph7_3 is_a: CHEBI:33647 ! alkatriene is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:36537 name: 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoate is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:36538 name: 2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoate is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:36539 name: kaurane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36540 name: ent-kaurane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:36541 name: sialotriaosylceramide is_a: CHEBI:28892 ! ganglioside [Term] id: CHEBI:36542 name: sialopentaosylceramide is_a: CHEBI:28892 ! ganglioside [Term] id: CHEBI:36543 name: sialotetraosylceramide is_a: CHEBI:28892 ! ganglioside [Term] id: CHEBI:36544 name: sialodiosylceramide is_a: CHEBI:28892 ! ganglioside [Term] id: CHEBI:36546 name: sialomonoglycosylceramide is_a: CHEBI:28892 ! ganglioside [Term] id: CHEBI:36547 name: pimarane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36550 name: sorbate subset: chebi_ph7_3 is_a: CHEBI:24554 ! hexadienoate [Term] id: CHEBI:36555 name: N-acetylanthranilic acid is_a: CHEBI:48470 ! amidobenzoic acid [Term] id: CHEBI:36557 name: N-methylanthranilate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:36558 name: 3-hydroxy-4-methylanthranilate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:36559 name: 3-hydroxyanthranilate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:24675 ! hydroxybenzoate is_a: CHEBI:63473 ! aromatic amino-acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36562 name: main-group coordination entity is_a: CHEBI:33240 ! coordination entity is_a: CHEBI:33579 ! main group molecular entity [Term] id: CHEBI:36564 name: N-benzoyl-4-methoxyanthranilate subset: chebi_ph7_3 is_a: CHEBI:25236 ! methoxybenzoate is_a: CHEBI:61666 ! amidobenzoate [Term] id: CHEBI:36571 name: prenylglycerol phosphate is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:36575 name: N-formylanthranilic acid is_a: CHEBI:48470 ! amidobenzoic acid [Term] id: CHEBI:36586 name: carbonyl compound is_a: CHEBI:36587 ! organic oxo compound is_a: CHEBI:36963 ! organooxygen compound relationship: has_part CHEBI:23019 ! carbonyl group [Term] id: CHEBI:36587 name: organic oxo compound is_a: CHEBI:72695 ! organic molecule relationship: has_part CHEBI:46629 ! oxo group [Term] id: CHEBI:36602 name: 2-dehydro-L-idonate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:36606 name: acid anhydride is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:36607 name: cyclic acid anhydride is_a: CHEBI:36606 ! acid anhydride [Term] id: CHEBI:36608 name: acyclic acid anhydride is_a: CHEBI:36606 ! acid anhydride [Term] id: CHEBI:36609 name: cyclic dicarboxylic anhydride is_a: CHEBI:35873 ! carboxylic anhydride is_a: CHEBI:36607 ! cyclic acid anhydride [Term] id: CHEBI:36611 name: fenchane subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:35662 ! terpenoid fundamental parent is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:36612 name: (1R,4S)-fenchone subset: chebi_ph7_3 is_a: CHEBI:4999 ! fenchone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36615 name: triterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:36622 name: benzimidazole is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:35570 ! mancude organic heterobicyclic parent [Term] id: CHEBI:36623 name: 4H-benzimidazole subset: chebi_ph7_3 is_a: CHEBI:36622 ! benzimidazole [Term] id: CHEBI:3663 name: cholesteryl palmitate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36635 name: p-toluic acid is_a: CHEBI:25280 ! methylbenzoic acid [Term] id: CHEBI:36638 name: fucosyl glycosphingolipid is_a: CHEBI:25513 ! neutral glycosphingolipid [Term] id: CHEBI:36639 name: 2H-benzimidazole subset: chebi_ph7_3 is_a: CHEBI:36622 ! benzimidazole [Term] id: CHEBI:36640 name: glycoheptaosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:36641 name: 3aH-benzimidazole subset: chebi_ph7_3 is_a: CHEBI:36622 ! benzimidazole [Term] id: CHEBI:36642 name: glycohexaosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:36647 name: 2,3-dihydroxy-p-cumate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:36654 name: 2,3-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:36655 name: glyoxylate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36656 name: phenylglyoxylate subset: chebi_ph7_3 is_a: CHEBI:51704 ! glyoxylates relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:36658 name: 6-methylsalicylate subset: chebi_ph7_3 is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:36659 name: 3-(4-hydroxyphenyl)lactate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58896 ! 2-hydroxy carboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36660 name: elemental tellurium is_a: CHEBI:33305 ! tellurium molecular entity [Term] id: CHEBI:36674 name: phenazine subset: chebi_ph7_3 is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:36680 ! heteranthrene is_a: CHEBI:38180 ! polycyclic heteroarene is_a: CHEBI:39201 ! phenazines is_a: CHEBI:50893 ! azaarene [Term] id: CHEBI:36680 name: heteranthrene is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:36682 name: polychlorinated dibenzodioxine is_a: CHEBI:134045 ! polychlorinated dibenzodioxines and related compounds is_a: CHEBI:23825 ! dibenzodioxine is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:36683 name: organochlorine compound subset: chebi_ph7_3 is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:23117 ! chlorine molecular entity [Term] id: CHEBI:36685 name: chlorocarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:36686 name: chloroarene is_a: CHEBI:23115 ! chlorohydrocarbon is_a: CHEBI:50887 ! haloarene [Term] id: CHEBI:36687 name: acyl chloride is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37579 ! acyl halide [Term] id: CHEBI:36688 name: heterotricyclic compound is_a: CHEBI:33671 ! heteropolycyclic compound [Term] id: CHEBI:36697 name: 1,2,4,5-tetrachlorobenzene subset: chebi_ph7_3 is_a: CHEBI:26888 ! tetrachlorobenzene [Term] id: CHEBI:36699 name: corticosteroid hormone is_a: CHEBI:26764 ! steroid hormone is_a: CHEBI:50858 ! corticosteroid [Term] id: CHEBI:36700 name: phosphocholines is_a: CHEBI:23213 ! choline ester is_a: CHEBI:23217 ! cholines is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36702 name: 2-acyl-1-alkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:68489 ! alkyl,acyl-sn-glycero-3-phosphocholine is_a: CHEBI:78186 ! 1-alkyl-2-acyl-glycero-3-phosphocholine [Term] id: CHEBI:36703 name: tetrachloro-1,4-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:77194 ! EC 2.7.1.33 (pantothenate kinase) inhibitor [Term] id: CHEBI:36707 name: 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:36709 name: aminoquinoline is_a: CHEBI:26513 ! quinolines is_a: CHEBI:33860 ! aromatic amine [Term] id: CHEBI:36711 name: phosphoethanolamine is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36712 name: 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:68520 ! alkyl,acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36713 name: 5alpha-androstane-3alpha,17beta-diol subset: chebi_ph7_3 is_a: CHEBI:18011 ! androstane-3alpha,17beta-diol relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:36717 name: monochlorobiphenyl is_a: CHEBI:35446 ! chlorobiphenyl is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:36721 name: pentachlorobiphenyl is_a: CHEBI:53156 ! polychlorobiphenyl [Term] id: CHEBI:36726 name: 17,20-dihydroxypregn-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:36727 name: 1-alkyl-2,3-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:166986 ! alkyldiacylglyceride [Term] id: CHEBI:36728 name: 20-hydroxypregn-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:36729 name: (20R)-20-hydroxypregn-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36728 ! 20-hydroxypregn-4-en-3-one [Term] id: CHEBI:36730 name: hydroxypregnenolone is_a: CHEBI:17087 ! ketone is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:36732 name: bilene-b is_a: CHEBI:36737 ! bilene [Term] id: CHEBI:36733 name: biladiene-ab is_a: CHEBI:36738 ! biladiene [Term] id: CHEBI:36735 name: biladienes is_a: CHEBI:25046 ! linear tetrapyrrole [Term] id: CHEBI:36736 name: bilenes is_a: CHEBI:25046 ! linear tetrapyrrole [Term] id: CHEBI:36737 name: bilene is_a: CHEBI:36736 ! bilenes [Term] id: CHEBI:36738 name: biladiene is_a: CHEBI:36735 ! biladienes [Term] id: CHEBI:36739 name: fenchane monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:36740 name: alpha-pinene subset: chebi_ph7_3 is_a: CHEBI:17187 ! pinene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36741 name: phycoerythrobilin is_a: CHEBI:36735 ! biladienes [Term] id: CHEBI:36742 name: p-menthan-3-one subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36743 name: germacrene is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:36745 name: cedrane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:36749 name: dipyrrins is_a: CHEBI:36316 ! dipyrrole [Term] id: CHEBI:36750 name: (R)-1-pyrroline-5-carboxylic acid is_a: CHEBI:1372 ! 1-pyrroline-5-carboxylic acid [Term] id: CHEBI:36751 name: pyrrole-2-carboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36753 name: eremophilane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:36754 name: vetispirane subset: chebi_ph7_3 is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:36756 name: farnesane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36757 name: farnesane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:36758 name: apo carotenoid sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:36760 name: ent-kaurane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:36761 name: 1-pyrroline-2-carboxylic acid is_a: CHEBI:19098 ! 1-pyrrolinecarboxylic acid [Term] id: CHEBI:36762 name: abietane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:36765 name: gibberellane is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:36766 name: ent-gibberellane is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:36768 name: casbane is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:36770 name: labdane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:36772 name: diterpenyl phosphate is_a: CHEBI:26875 ! terpenyl phosphate [Term] id: CHEBI:36773 name: camphor subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:23446 ! cyclic monoterpene ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:36775 name: bornane-2,5-dione subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid [Term] id: CHEBI:36776 name: (1S)-bornane-2,5-dione subset: chebi_ph7_3 is_a: CHEBI:36775 ! bornane-2,5-dione [Term] id: CHEBI:36780 name: triterpenyl phosphate is_a: CHEBI:26875 ! terpenyl phosphate [Term] id: CHEBI:36781 name: 1-pyrrolinium subset: chebi_ph7_3 is_a: CHEBI:23763 ! pyrroline relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36782 name: tetraterpenyl phosphate is_a: CHEBI:26875 ! terpenyl phosphate [Term] id: CHEBI:36783 name: apo carotenoid triterpenoid is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:36785 name: carbobicyclic compound is_a: CHEBI:33636 ! bicyclic compound is_a: CHEBI:35294 ! carbopolycyclic compound [Term] id: CHEBI:36786 name: tetralins is_a: CHEBI:33836 ! benzenoid aromatic compound is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:36810 name: (trifluoromethyl)benzene subset: chebi_ph7_3 is_a: CHEBI:46695 ! fluorohydrocarbon is_a: CHEBI:83565 ! (trifluoromethyl)benzenes relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:36816 name: oxime O-ether is_a: CHEBI:25698 ! ether is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:36818 name: seco-cholestane is_a: CHEBI:35788 ! seco-steroid [Term] id: CHEBI:36819 name: seco-ergostane is_a: CHEBI:35788 ! seco-steroid [Term] id: CHEBI:36820 name: ring assembly is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:36823 name: pseudohalo group is_a: CHEBI:24433 ! group [Term] id: CHEBI:36828 name: pseudohalide anion is_a: CHEBI:36829 ! polyatomic monoanion [Term] id: CHEBI:36829 name: polyatomic monoanion is_a: CHEBI:33273 ! polyatomic anion is_a: CHEBI:36830 ! monoanion [Term] id: CHEBI:36830 name: monoanion is_a: CHEBI:22563 ! anion [Term] id: CHEBI:36834 name: 3-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36835 name: 3alpha-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:36836 name: 3beta-hydroxy steroid subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:36838 name: 17-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36840 name: 16-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36841 name: 11-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36842 name: 19-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36843 name: 7alpha-hydroxy steroid is_a: CHEBI:36844 ! 7-hydroxy steroid [Term] id: CHEBI:36844 name: 7-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36845 name: 12-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36846 name: 12alpha-hydroxy steroid is_a: CHEBI:36845 ! 12-hydroxy steroid [Term] id: CHEBI:36847 name: 12beta-hydroxy steroid is_a: CHEBI:36845 ! 12-hydroxy steroid [Term] id: CHEBI:36848 name: 5-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36849 name: 6-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36850 name: 6alpha-hydroxy steroid is_a: CHEBI:36849 ! 6-hydroxy steroid [Term] id: CHEBI:36851 name: 6beta-hydroxy steroid is_a: CHEBI:36849 ! 6-hydroxy steroid [Term] id: CHEBI:36852 name: 26-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36853 name: hydroxy seco-steroid is_a: CHEBI:35350 ! hydroxy steroid is_a: CHEBI:35788 ! seco-steroid [Term] id: CHEBI:36854 name: 20-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36855 name: 18-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36856 name: hydrogen isocyanide is_a: CHEBI:33405 ! hydracid [Term] id: CHEBI:36857 name: 2-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36859 name: 2beta-hydroxy steroid is_a: CHEBI:36857 ! 2-hydroxy steroid [Term] id: CHEBI:36860 name: 14-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36861 name: 14alpha-hydroxy steroid is_a: CHEBI:36860 ! 14-hydroxy steroid [Term] id: CHEBI:36863 name: 22-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36864 name: 25-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36865 name: 24-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36866 name: 23-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:36871 name: inorganic radical is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:26519 ! radical [Term] id: CHEBI:36872 name: organic radical is_a: CHEBI:26519 ! radical [Term] id: CHEBI:36873 name: radical anion is_a: CHEBI:22563 ! anion is_a: CHEBI:36875 ! radical ion [Term] id: CHEBI:36874 name: radical cation is_a: CHEBI:36875 ! radical ion is_a: CHEBI:36916 ! cation [Term] id: CHEBI:36875 name: radical ion is_a: CHEBI:24870 ! ion is_a: CHEBI:26519 ! radical [Term] id: CHEBI:36876 name: inorganic radical anion is_a: CHEBI:36873 ! radical anion is_a: CHEBI:36878 ! inorganic radical ion [Term] id: CHEBI:36877 name: organic radical anion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:36873 ! radical anion is_a: CHEBI:36880 ! organic radical ion [Term] id: CHEBI:36878 name: inorganic radical ion is_a: CHEBI:36871 ! inorganic radical is_a: CHEBI:36875 ! radical ion [Term] id: CHEBI:36879 name: inorganic radical cation is_a: CHEBI:36874 ! radical cation is_a: CHEBI:36878 ! inorganic radical ion [Term] id: CHEBI:36880 name: organic radical ion is_a: CHEBI:25699 ! organic ion is_a: CHEBI:36872 ! organic radical is_a: CHEBI:36875 ! radical ion [Term] id: CHEBI:36882 name: (3S)-citramalyl-CoA is_a: CHEBI:15457 ! citramalyl-CoA [Term] id: CHEBI:36883 name: 6-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:36884 name: 26-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:36885 name: 20-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:36886 name: 21-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:36887 name: 18-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:36891 name: diatomic iodine is_a: CHEBI:36893 ! elemental iodine [Term] id: CHEBI:36892 name: elemental fluorine is_a: CHEBI:33434 ! elemental halogen [Term] id: CHEBI:36893 name: elemental iodine is_a: CHEBI:33434 ! elemental halogen [Term] id: CHEBI:36894 name: elemental bromine is_a: CHEBI:33434 ! elemental halogen [Term] id: CHEBI:36895 name: monoatomic fluorine is_a: CHEBI:36892 ! elemental fluorine [Term] id: CHEBI:36896 name: monoatomic bromine is_a: CHEBI:36894 ! elemental bromine [Term] id: CHEBI:36897 name: monoatomic iodine is_a: CHEBI:36893 ! elemental iodine [Term] id: CHEBI:368997 name: N-benzyloxycarbonylglycinate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:36902 name: chalcogen hydride is_a: CHEBI:33242 ! inorganic hydride is_a: CHEBI:33304 ! chalcogen molecular entity [Term] id: CHEBI:36903 name: selenium hydride is_a: CHEBI:26628 ! selenium molecular entity is_a: CHEBI:36902 ! chalcogen hydride [Term] id: CHEBI:36904 name: elemental selenium is_a: CHEBI:26628 ! selenium molecular entity [Term] id: CHEBI:36914 name: inorganic ion is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:24870 ! ion [Term] id: CHEBI:36915 name: inorganic cation is_a: CHEBI:36914 ! inorganic ion is_a: CHEBI:36916 ! cation [Term] id: CHEBI:36916 name: cation is_a: CHEBI:24870 ! ion [Term] id: CHEBI:36919 name: antimony molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_part CHEBI:30513 ! antimony atom [Term] id: CHEBI:36920 name: antimony oxoacid is_a: CHEBI:33408 ! pnictogen oxoacid is_a: CHEBI:50007 ! antimony coordination entity [Term] id: CHEBI:36921 name: antimony oxoanion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:33459 ! pnictogen oxoanion is_a: CHEBI:50007 ! antimony coordination entity [Term] id: CHEBI:36926 name: but-2-enoyl-CoA is_a: CHEBI:22961 ! butenoyl-CoA [Term] id: CHEBI:36941 name: (S)-mandelonitrile subset: chebi_ph7_3 is_a: CHEBI:16910 ! mandelonitrile [Term] id: CHEBI:36942 name: pterin phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:26375 ! pterins is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36943 name: aryl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36944 name: steroid phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36946 name: thiourea subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas is_a: CHEBI:51276 ! thioureas is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23240 ! chromophore [Term] id: CHEBI:36948 name: oxoalkyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36949 name: hydroxyalkyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36951 name: aminoacyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:26051 ! phosphoamino acid [Term] id: CHEBI:36952 name: carboxyalkyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:36954 name: condensed ureas is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:36958 name: carbonothioic O,O-acid is_a: CHEBI:36960 ! carbonothioic acid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:36959 name: carbonothioic O,S-acid is_a: CHEBI:36960 ! carbonothioic acid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:36960 name: carbonothioic acid is_a: CHEBI:35605 ! carbon oxoacid is_a: CHEBI:36961 ! chalcocarbonic acid [Term] id: CHEBI:36961 name: chalcocarbonic acid is_a: CHEBI:36962 ! organochalcogen compound [Term] id: CHEBI:36962 name: organochalcogen compound is_a: CHEBI:33285 ! heteroorganic entity is_a: CHEBI:33304 ! chalcogen molecular entity [Term] id: CHEBI:36963 name: organooxygen compound is_a: CHEBI:25806 ! oxygen molecular entity is_a: CHEBI:36962 ! organochalcogen compound [Term] id: CHEBI:36969 name: farnesoic acid is_a: CHEBI:62499 ! methyl-branched fatty acid is_a: CHEBI:73155 ! trienoic fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:36970 name: vitamin B6 phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:37734 ! phosphoric ester relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:36971 name: dodecatrienoic acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:36972 name: dodeca-2,6,10-trienoic acid is_a: CHEBI:36971 ! dodecatrienoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:36974 name: aminoglycoside phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:36976 name: nucleotide is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:36979 name: N-glycosylpyridine is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:36980 name: pyridine nucleotide is_a: CHEBI:26421 ! pyridines is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:36981 name: flavin nucleotide is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:36982 name: cyclic purine nucleotide is_a: CHEBI:23447 ! cyclic nucleotide is_a: CHEBI:26395 ! purine nucleotide [Term] id: CHEBI:36983 name: cyclic pyrimidine nucleotide is_a: CHEBI:23447 ! cyclic nucleotide is_a: CHEBI:26441 ! pyrimidine nucleotide [Term] id: CHEBI:36986 name: mesaconate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:36987 name: 3'-deoxyribonucleoside is_a: CHEBI:23636 ! deoxyribonucleoside is_a: CHEBI:47018 ! monohydroxytetrahydrofuran [Term] id: CHEBI:36988 name: 5'-deoxyribonucleoside is_a: CHEBI:23636 ! deoxyribonucleoside [Term] id: CHEBI:36991 name: C-glycosyl pyrimidine is_a: CHEBI:37086 ! C-nucleoside [Term] id: CHEBI:36993 name: purine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:18241 ! 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:26388 ! purine 2'-deoxyribonucleoside monophosphate is_a: CHEBI:26390 ! purine 2'-deoxyribonucleotide [Term] id: CHEBI:36994 name: pyrimidine 2'-deoxyribonucleoside 3'-monophosphate is_a: CHEBI:19252 ! 2'-deoxyribonucleoside 3'-monophosphate is_a: CHEBI:26434 ! pyrimidine 2'-deoxyribonucleoside monophosphate is_a: CHEBI:26436 ! pyrimidine 2'-deoxyribonucleotide [Term] id: CHEBI:36995 name: pyrimidine 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:18241 ! 2'-deoxyribonucleoside 5'-monophosphate is_a: CHEBI:26434 ! pyrimidine 2'-deoxyribonucleoside monophosphate is_a: CHEBI:26436 ! pyrimidine 2'-deoxyribonucleotide [Term] id: CHEBI:36999 name: perillic acid is_a: CHEBI:23483 ! cyclohexenecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37000 name: (4S,5R)-dethiobiotin is_a: CHEBI:16691 ! dethiobiotin [Term] id: CHEBI:37005 name: (3S,5R)-1-pyrroline-3-hydroxy-5-carboxylic acid is_a: CHEBI:27391 ! 1-pyrroline-3-hydroxy-5-carboxylic acid [Term] id: CHEBI:37007 name: nicotinamide dinucleotide is_a: CHEBI:25527 ! nicotinamide nucleotide is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:37008 name: nicotinic acid mononucleotide is_a: CHEBI:25534 ! nicotinic acid nucleotide [Term] id: CHEBI:37009 name: ribonucleoside 3'-monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate is_a: CHEBI:37013 ! ribonucleoside 3'-phosphate [Term] id: CHEBI:37010 name: ribonucleoside 5'-monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate is_a: CHEBI:37015 ! ribonucleoside 5'-phosphate [Term] id: CHEBI:37011 name: 4-oxoproline is_a: CHEBI:25801 ! oxoproline relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:37012 name: L-3-oxoalanine is_a: CHEBI:17740 ! 3-oxoalanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:37013 name: ribonucleoside 3'-phosphate is_a: CHEBI:16492 ! nucleoside 3'-phosphate is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:37014 name: 2'-deoxyribonucleoside 3'-phosphate is_a: CHEBI:16492 ! nucleoside 3'-phosphate is_a: CHEBI:19260 ! 2'-deoxyribonucleotide [Term] id: CHEBI:37015 name: ribonucleoside 5'-phosphate is_a: CHEBI:16701 ! nucleoside 5'-phosphate is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:37016 name: 2'-deoxyribonucleoside 5'-phosphate is_a: CHEBI:16701 ! nucleoside 5'-phosphate is_a: CHEBI:19260 ! 2'-deoxyribonucleotide [Term] id: CHEBI:37018 name: pyrimidine ribonucleoside 3'-monophosphate is_a: CHEBI:26443 ! pyrimidine ribonucleoside monophosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37009 ! ribonucleoside 3'-monophosphate [Term] id: CHEBI:37020 name: purine ribonucleoside 3'-monophosphate is_a: CHEBI:26397 ! purine ribonucleoside monophosphate is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:37009 ! ribonucleoside 3'-monophosphate [Term] id: CHEBI:37021 name: purine ribonucleoside 5'-monophosphate is_a: CHEBI:26397 ! purine ribonucleoside monophosphate is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:37022 name: amino-acid anion is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:37023 name: L-2-aminoadipic acid is_a: CHEBI:37024 ! 2-aminoadipic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37024 name: 2-aminoadipic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:37025 name: D-2-aminoadipic acid is_a: CHEBI:37024 ! 2-aminoadipic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:370252 name: xylitol 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:37030 name: 3-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:37034 name: O-acetyl-D-homoserine is_a: CHEBI:7671 ! O-acetylhomoserine [Term] id: CHEBI:37035 name: 3-hydroxyhexanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:37036 name: purine 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:16350 ! 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:26387 ! purine 2'-deoxyribonucleoside diphosphate is_a: CHEBI:26390 ! purine 2'-deoxyribonucleotide [Term] id: CHEBI:37037 name: pyrimidine 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:16350 ! 2'-deoxyribonucleoside 5'-diphosphate is_a: CHEBI:26433 ! pyrimidine 2'-deoxyribonucleoside diphosphate is_a: CHEBI:26436 ! pyrimidine 2'-deoxyribonucleotide [Term] id: CHEBI:37038 name: purine ribonucleoside 5'-diphosphate is_a: CHEBI:26396 ! purine ribonucleoside diphosphate is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:37075 ! ribonucleoside 5'-diphosphate [Term] id: CHEBI:37039 name: pyrimidine ribonucleoside 5'-diphosphate is_a: CHEBI:26442 ! pyrimidine ribonucleoside diphosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37075 ! ribonucleoside 5'-diphosphate [Term] id: CHEBI:37040 name: C-nucleoside phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37041 name: N-methyl-2-oxoglutaramic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:37042 name: purine 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:16381 ! 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:26389 ! purine deoxyribonucleoside triphosphate is_a: CHEBI:26390 ! purine 2'-deoxyribonucleotide [Term] id: CHEBI:37043 name: pyrimidine 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:16381 ! 2'-deoxyribonucleoside 5'-triphosphate is_a: CHEBI:26435 ! pyrimidine deoxyribonucleoside triphosphate is_a: CHEBI:26436 ! pyrimidine 2'-deoxyribonucleotide [Term] id: CHEBI:37044 name: pyrimidine ribonucleoside 5'-triphosphate is_a: CHEBI:26444 ! pyrimidine ribonucleoside triphosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37076 ! ribonucleoside 5'-triphosphate [Term] id: CHEBI:37045 name: purine ribonucleoside 5'-triphosphate is_a: CHEBI:26398 ! purine ribonucleoside triphosphate is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:37076 ! ribonucleoside 5'-triphosphate [Term] id: CHEBI:37046 name: p-menth-8-en-3-one subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:37047 name: (+)-cis-isopulegone subset: chebi_ph7_3 is_a: CHEBI:37046 ! p-menth-8-en-3-one [Term] id: CHEBI:37049 name: (S)-3-hydroxyhexanoic acid is_a: CHEBI:37035 ! 3-hydroxyhexanoic acid [Term] id: CHEBI:37050 name: 3-hydroxybutanoyl-CoA is_a: CHEBI:24685 ! hydroxybutanoyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:37051 name: 3-hydroxy-2-methylbutanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:37052 name: (2S,3S)-3-hydroxy-2-methylbutanoic acid is_a: CHEBI:37051 ! 3-hydroxy-2-methylbutanoic acid [Term] id: CHEBI:37054 name: 3-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37056 name: nucleoside tetraphosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:37058 name: ribonucleoside tetraphosphate is_a: CHEBI:37056 ! nucleoside tetraphosphate [Term] id: CHEBI:37059 name: purine nucleoside tetraphosphate is_a: CHEBI:37056 ! nucleoside tetraphosphate [Term] id: CHEBI:37063 name: purine ribonucleoside tetraphosphate is_a: CHEBI:37058 ! ribonucleoside tetraphosphate is_a: CHEBI:37059 ! purine nucleoside tetraphosphate [Term] id: CHEBI:37067 name: purine ribonucleoside 5'-tetraphosphate is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:37063 ! purine ribonucleoside tetraphosphate is_a: CHEBI:37077 ! ribonucleoside 5'-tetraphosphate [Term] id: CHEBI:37070 name: 2-methylbutyric acid is_a: CHEBI:38653 ! methylbutyric acid relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37075 name: ribonucleoside 5'-diphosphate is_a: CHEBI:37015 ! ribonucleoside 5'-phosphate [Term] id: CHEBI:37076 name: ribonucleoside 5'-triphosphate is_a: CHEBI:37015 ! ribonucleoside 5'-phosphate [Term] id: CHEBI:37077 name: ribonucleoside 5'-tetraphosphate is_a: CHEBI:37015 ! ribonucleoside 5'-phosphate [Term] id: CHEBI:37079 name: 2-methylacetoacetic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:37080 name: acrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37081 name: 3-aminobutanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:37084 name: 3-hydroxyisovaleric acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37086 name: C-nucleoside is_a: CHEBI:20857 ! C-glycosyl compound [Term] id: CHEBI:37088 name: anthrol is_a: CHEBI:37507 ! anthracenol [Term] id: CHEBI:37089 name: ortho-fused tricyclic hydrocarbon is_a: CHEBI:35427 ! ortho-fused polycyclic hydrocarbon is_a: CHEBI:51119 ! tricyclic hydrocarbon [Term] id: CHEBI:37092 name: 2'-deoxycytidine phosphate is_a: CHEBI:23621 ! deoxycytidine phosphate [Term] id: CHEBI:37096 name: adenosine 5'-phosphate is_a: CHEBI:22256 ! adenosine phosphate [Term] id: CHEBI:37097 name: adenosine 3'-phosphate is_a: CHEBI:22256 ! adenosine phosphate [Term] id: CHEBI:37098 name: 3-hydroxyoctanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:37099 name: (R)-3-hydroxyoctanoic acid is_a: CHEBI:37098 ! 3-hydroxyoctanoic acid is_a: CHEBI:85678 ! (3R)-3-hydroxy fatty acid [Term] id: CHEBI:371 name: (S)-1-pyrroline-5-carboxylic acid is_a: CHEBI:1372 ! 1-pyrroline-5-carboxylic acid [Term] id: CHEBI:37100 name: (S)-3-hydroxyoctanoic acid is_a: CHEBI:37098 ! 3-hydroxyoctanoic acid [Term] id: CHEBI:37102 name: nucleoside pentaphosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:37105 name: 2-aminopteridin-4(1H)-one subset: chebi_ph7_3 is_a: CHEBI:26374 ! pterin [Term] id: CHEBI:37107 name: 7-methyl-3-oxooctanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:37108 name: 7-methyloctanoic acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:37120 name: guanosine 3'-phosphate is_a: CHEBI:24455 ! guanosine phosphate [Term] id: CHEBI:37121 name: guanosine 5'-phosphate is_a: CHEBI:24455 ! guanosine phosphate [Term] id: CHEBI:37123 name: nucleoside bisphosphate is_a: CHEBI:25608 ! nucleoside phosphate [Term] id: CHEBI:37124 name: guanosine bisphosphate is_a: CHEBI:24455 ! guanosine phosphate is_a: CHEBI:61079 ! ribonucleoside bisphosphate is_a: CHEBI:64620 ! purine ribonucleoside bisphosphate [Term] id: CHEBI:37125 name: 5-hydroxy monocarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:37127 name: 3-methylbut-2-enoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37128 name: caesium molecular entity is_a: CHEBI:33296 ! alkali metal molecular entity relationship: has_part CHEBI:30514 ! caesium atom [Term] id: CHEBI:37141 name: organobromine compound subset: chebi_ph7_3 is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:22928 ! bromine molecular entity [Term] id: CHEBI:37142 name: organoiodine compound subset: chebi_ph7_3 is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:24860 ! iodine molecular entity [Term] id: CHEBI:37143 name: organofluorine compound subset: chebi_ph7_3 is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:24062 ! fluorine molecular entity [Term] id: CHEBI:37146 name: molybdopterin dinucleotide is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:37147 name: dibromobenzene is_a: CHEBI:37149 ! bromobenzenes [Term] id: CHEBI:37148 name: bromoarene is_a: CHEBI:22926 ! bromohydrocarbon is_a: CHEBI:50887 ! haloarene [Term] id: CHEBI:37149 name: bromobenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:37151 name: 1,3-dibromobenzene subset: chebi_ph7_3 is_a: CHEBI:37147 ! dibromobenzene [Term] id: CHEBI:37153 name: EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor is_a: CHEBI:76775 ! EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor [Term] id: CHEBI:37154 name: fumarate(1-) is_a: CHEBI:37155 ! hydrogen butenedioate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:37155 name: hydrogen butenedioate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:37156 name: maleate(1-) is_a: CHEBI:132951 ! maleate is_a: CHEBI:37155 ! hydrogen butenedioate [Term] id: CHEBI:37157 name: 3-oxodecanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid [Term] id: CHEBI:37158 name: bromocarboxylic acid is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:37162 name: trans-2-dodecenoic acid is_a: CHEBI:38371 ! 2-dodecenoic acid [Term] id: CHEBI:37163 name: glucan is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:37164 name: homopolysaccharide is_a: CHEBI:18154 ! polysaccharide [Term] id: CHEBI:37165 name: galactan is_a: CHEBI:37164 ! homopolysaccharide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:37166 name: xylan is_a: CHEBI:37164 ! homopolysaccharide is_a: CHEBI:61266 ! hemicellulose [Term] id: CHEBI:37175 name: organic hydride is_a: CHEBI:33692 ! hydrides [Term] id: CHEBI:37176 name: mononuclear parent hydride is_a: CHEBI:33692 ! hydrides [Term] id: CHEBI:37190 name: silicon coordination entity is_a: CHEBI:26677 ! silicon molecular entity is_a: CHEBI:36562 ! main-group coordination entity [Term] id: CHEBI:37191 name: silicon oxoanion is_a: CHEBI:24834 ! inorganic anion is_a: CHEBI:35406 ! oxoanion is_a: CHEBI:37190 ! silicon coordination entity [Term] id: CHEBI:37193 name: elemental lead is_a: CHEBI:33585 ! lead molecular entity [Term] id: CHEBI:37196 name: bismuth molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_part CHEBI:33301 ! bismuth atom [Term] id: CHEBI:37205 name: pentol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:37206 name: hexol is_a: CHEBI:26191 ! polyol [Term] id: CHEBI:37207 name: cis-3-dodecenoic acid is_a: CHEBI:38373 ! 3-dodecenoic acid [Term] id: CHEBI:37208 name: pinitol is_a: CHEBI:37205 ! pentol is_a: CHEBI:61362 ! cyclitol ether relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37209 name: L-pinitol subset: chebi_ph7_3 is_a: CHEBI:37208 ! pinitol [Term] id: CHEBI:37237 name: elemental molybdenum is_a: CHEBI:25370 ! molybdenum molecular entity [Term] id: CHEBI:37239 name: molybdenum cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:37237 ! elemental molybdenum [Term] id: CHEBI:37240 name: adenosine 3',5'-bisphosphate is_a: CHEBI:22251 ! adenosine bisphosphate [Term] id: CHEBI:37245 name: (E)-3-methylglutaconic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:37246 name: elemental sodium is_a: CHEBI:26712 ! sodium molecular entity [Term] id: CHEBI:37247 name: elemental potassium is_a: CHEBI:26217 ! potassium molecular entity [Term] id: CHEBI:37248 name: 3-hydroxypalmitic acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid is_a: CHEBI:72726 ! hydroxypalmitic acid [Term] id: CHEBI:37250 name: (S)-3-hydroxypalmitic acid is_a: CHEBI:37248 ! 3-hydroxypalmitic acid [Term] id: CHEBI:37251 name: 3-oxopalmitic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:37252 name: (E)-hexadec-2-enoic acid is_a: CHEBI:24548 ! hexadecenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:37253 name: elemental zinc is_a: CHEBI:27364 ! zinc molecular entity [Term] id: CHEBI:37257 name: phytanate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:83972 ! 3-methyl fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37258 name: 2-hydroxyphytanic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid [Term] id: CHEBI:37259 name: 3-oxopimelic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:37260 name: hept-2-enedioic acid is_a: CHEBI:24522 ! heptenedioic acid [Term] id: CHEBI:37270 name: 3-oxotetradecanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:37271 name: trans-2-tetradecenoic acid is_a: CHEBI:61366 ! 2-tetradecenoic acid [Term] id: CHEBI:37273 name: cis-11-tetradecenoic acid is_a: CHEBI:38331 ! 11-tetradecenoic acid [Term] id: CHEBI:37274 name: trans-11-tetradecenoic acid is_a: CHEBI:38331 ! 11-tetradecenoic acid [Term] id: CHEBI:37276 name: (1-hydroxycyclohexyl)acetic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:37283 name: heptanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:37287 name: (3R)-3-isopropenyl-6-oxoheptanoic acid is_a: CHEBI:64264 ! 3-isopropenyl-6-oxoheptanoic acid [Term] id: CHEBI:37290 name: 1-(phosphoribosyl)imidazolecarboxamide is_a: CHEBI:26556 ! 1-ribosylimidazolecarboxamide is_a: CHEBI:37292 ! 1-(phosphoribosyl)imidazole [Term] id: CHEBI:37291 name: (3S)-3-isopropenyl-6-oxoheptanoic acid is_a: CHEBI:64264 ! 3-isopropenyl-6-oxoheptanoic acid [Term] id: CHEBI:37292 name: 1-(phosphoribosyl)imidazole is_a: CHEBI:26562 ! ribose phosphate is_a: CHEBI:37293 ! 1-ribosylimidazole [Term] id: CHEBI:37293 name: 1-ribosylimidazole is_a: CHEBI:48117 ! 1-glycosylimidazole [Term] id: CHEBI:37296 name: 1-alkyl-2-acyl-sn-glycerol 3-phosphate is_a: CHEBI:17088 ! monoacyl-sn-glycerol 3-phosphate is_a: CHEBI:22329 ! alkyl-sn-glycerol 3-phosphate [Term] id: CHEBI:37316 name: (E,E)-piperic acid is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37318 name: 2-oxopent-4-enoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:37319 name: 2-hydroxypenta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:37322 name: penta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:37323 name: 7,8-dimethylisoalloxazine is_a: CHEBI:37324 ! 7,8-dimethylbenzo[g]pteridine-2,4-dione [Term] id: CHEBI:37324 name: 7,8-dimethylbenzo[g]pteridine-2,4-dione is_a: CHEBI:38925 ! benzopteridine [Term] id: CHEBI:37325 name: alloxazine subset: chebi_ph7_3 is_a: CHEBI:37326 ! benzo[g]pteridine-2,4-dione [Term] id: CHEBI:37326 name: benzo[g]pteridine-2,4-dione is_a: CHEBI:38925 ! benzopteridine [Term] id: CHEBI:37327 name: isoalloxazine is_a: CHEBI:37326 ! benzo[g]pteridine-2,4-dione [Term] id: CHEBI:37328 name: phosphatidylinositol bisphosphate is_a: CHEBI:28765 ! phosphatidylinositol phosphate [Term] id: CHEBI:37329 name: phosphatidylinositol 5-phosphate is_a: CHEBI:26036 ! phosphatidylinositol monophosphate [Term] id: CHEBI:37331 name: (E)-penta-2,4-dienoic acid is_a: CHEBI:35964 ! penta-2,4-dienoic acid [Term] id: CHEBI:37332 name: tropane alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:38295 ! azabicycloalkane [Term] id: CHEBI:37334 name: diagnostic imaging agent is_a: CHEBI:33295 ! diagnostic agent [Term] id: CHEBI:37335 name: MRI contrast agent is_a: CHEBI:37334 ! diagnostic imaging agent [Term] id: CHEBI:37371 name: (S)-3-hydroxydecanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:37373 name: (S)-3-hydroxyisobutyric acid is_a: CHEBI:18064 ! 3-hydroxyisobutyric acid [Term] id: CHEBI:37374 name: (S)-3-hydroxytetradecanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:37390 name: azoxy compound is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:37392 name: ribonic acid phosphate is_a: CHEBI:22300 ! aldonic acid phosphate [Term] id: CHEBI:37393 name: 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate is_a: CHEBI:17264 ! phosphatidylglycerol phosphate [Term] id: CHEBI:37395 name: mucopolysaccharide is_a: CHEBI:18085 ! glycosaminoglycan [Term] id: CHEBI:37396 name: proteoglycan is_a: CHEBI:17089 ! glycoprotein is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:37397 name: chondroitin sulfate is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37395 ! mucopolysaccharide [Term] id: CHEBI:37398 name: nucleotide-aldonic acid is_a: CHEBI:35241 ! nucleotide-carbohydrate [Term] id: CHEBI:37404 name: elemental copper is_a: CHEBI:23377 ! copper molecular entity [Term] id: CHEBI:37407 name: cyclic ether is_a: CHEBI:25698 ! ether is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:37409 name: crown compound is_a: CHEBI:24532 ! organic heterocyclic compound [Term] id: CHEBI:37412 name: phosphoshikimic acid is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37416 name: EC 2.7.7.6 (RNA polymerase) inhibitor is_a: CHEBI:76815 ! EC 2.7.7.* (nucleotidyltransferase) inhibitor [Term] id: CHEBI:37420 name: 12-hydroxyjasmonic acid is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:36140 ! cyclopentanones is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37421 name: carbohydrate lactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:37422 name: arabinono-1,4-lactone is_a: CHEBI:22598 ! arabinonolactone [Term] id: CHEBI:37424 name: sterol 3-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:61655 ! steroid saponin [Term] id: CHEBI:37425 name: L-galactonic acid is_a: CHEBI:24149 ! galactonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:37426 name: aldarolactone is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:37421 ! carbohydrate lactone [Term] id: CHEBI:37427 name: ketoaldonolactone is_a: CHEBI:37421 ! carbohydrate lactone [Term] id: CHEBI:37429 name: aldonolactone phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:37431 name: uronolactone is_a: CHEBI:37421 ! carbohydrate lactone [Term] id: CHEBI:37432 name: mannonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:37433 name: gulonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:37434 name: ribonolactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:37440 name: 3-oxoadipic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37445 name: folic acids is_a: CHEBI:176842 ! vitamin B9 is_a: CHEBI:26375 ! pterins is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:37448 name: 2-dehydro-3-deoxy-L-fuconate subset: chebi_ph7_3 is_a: CHEBI:24961 ! ketoaldonate is_a: CHEBI:33769 ! fuconates [Term] id: CHEBI:37449 name: 2-deoxy-alpha-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:19555 ! 2-deoxy-D-glucoside [Term] id: CHEBI:37450 name: 2-methoxyestrone 3-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:37453 name: phenanthrenediol is_a: CHEBI:25961 ! phenanthrenes [Term] id: CHEBI:37455 name: ribulose 5-phosphate is_a: CHEBI:26573 ! ribulose phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:37462 name: L-tagatose is_a: CHEBI:33954 ! tagatose [Term] id: CHEBI:37463 name: ADP-D-ribose 2'-phosphate is_a: CHEBI:17193 ! ADP-aldose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:37464 name: 3,4-dihydrophenanthrene-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:23738 ! dihydrophenanthrenediol [Term] id: CHEBI:37465 name: (3R,4S)-3,4-dihydrophenanthrene-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:23286 ! cis-3,4-dihydrophenanthrene-3,4-diol [Term] id: CHEBI:37466 name: O-phosphocorrinoid is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37469 name: 9,10-dihydrophenanthrene-9,10-diol subset: chebi_ph7_3 is_a: CHEBI:23738 ! dihydrophenanthrenediol [Term] id: CHEBI:37470 name: trans-9,10-dihydrophenanthrene-9,10-diol is_a: CHEBI:37469 ! 9,10-dihydrophenanthrene-9,10-diol [Term] id: CHEBI:37480 name: D-galactopyranose 1-phosphate is_a: CHEBI:20960 ! galactose phosphate relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:37481 name: amidoalkyl phosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37483 name: monohydroxyanthraquinone is_a: CHEBI:37485 ! hydroxyanthraquinones [Term] id: CHEBI:37484 name: dihydroxyanthraquinone is_a: CHEBI:37485 ! hydroxyanthraquinones [Term] id: CHEBI:37485 name: hydroxyanthraquinones is_a: CHEBI:22580 ! anthraquinone is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:37488 name: trihydroxyanthraquinone is_a: CHEBI:37485 ! hydroxyanthraquinones [Term] id: CHEBI:37493 name: 1D-myo-inositol 5-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate [Term] id: CHEBI:37496 name: tetrahydroxyanthraquinone is_a: CHEBI:37485 ! hydroxyanthraquinones [Term] id: CHEBI:37507 name: anthracenol is_a: CHEBI:33853 ! phenols is_a: CHEBI:46955 ! anthracenes [Term] id: CHEBI:37511 name: thiophosphate is_a: CHEBI:26020 ! phosphate [Term] id: CHEBI:37512 name: organic thiophosphate is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:25716 ! organothiophosphorus compound is_a: CHEBI:37511 ! thiophosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37515 name: D-fructofuranose 1-phosphate is_a: CHEBI:78736 ! D-fructose 1-phosphate [Term] id: CHEBI:37519 name: cyclohepta-1,3,5-triene subset: chebi_ph7_3 is_a: CHEBI:33662 ! annulene is_a: CHEBI:51732 ! cycloheptatriene [Term] id: CHEBI:37525 name: O-phospho-L-threonine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84189 ! L-threonine derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:37526 name: tigliane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:37527 name: acid is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:37528 name: sn-glycerol 1-phosphates is_a: CHEBI:26707 ! glycerol phosphate [Term] id: CHEBI:37530 name: phosphatidylinositol 4-phosphate is_a: CHEBI:26036 ! phosphatidylinositol monophosphate [Term] id: CHEBI:37531 name: polyprenyl diphosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:37532 name: phorbol ester is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:52557 ! tetracyclic diterpenoid [Term] id: CHEBI:37533 name: azo compound is_a: CHEBI:51143 ! nitrogen molecular entity relationship: has_part CHEBI:30106 ! azo group [Term] id: CHEBI:37534 name: ribitol 5-phosphate is_a: CHEBI:22295 ! alditol 5-phosphate is_a: CHEBI:26554 ! ribitol phosphate [Term] id: CHEBI:37537 name: phorbol 13-acetate 12-myristate subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:37532 ! phorbol ester is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:51307 ! diester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:52290 ! mitogen relationship: has_role CHEBI:64018 ! protein kinase C agonist relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:70982 ! reactive oxygen species generator relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37545 name: altrarate(2-) is_a: CHEBI:48916 ! altraric acid anion [Term] id: CHEBI:37546 name: D-altrarate(2-) subset: chebi_ph7_3 is_a: CHEBI:37545 ! altrarate(2-) [Term] id: CHEBI:37547 name: L-altrarate(2-) subset: chebi_ph7_3 is_a: CHEBI:37545 ! altrarate(2-) [Term] id: CHEBI:37549 name: glycoside phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:37550 name: sphingosine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:63114 ! sphingosine-1-phosphate receptor agonist relationship: has_role CHEBI:63173 ! T-cell proliferation inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:37554 name: fatty acyl-CoA is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:37555 name: omega-carboxyacyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:37556 name: O-(alpha-D-mannosyl)-L-serine is_a: CHEBI:21957 ! O-glycosyl-L-serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:37557 name: O-(alpha-D-mannosyl)-L-threonine is_a: CHEBI:21958 ! O-glycosyl-L-threonine [Term] id: CHEBI:37558 name: aryl dialkyl phosphate subset: chebi_ph7_3 is_a: CHEBI:16648 ! dialkyl phosphate is_a: CHEBI:36943 ! aryl phosphate [Term] id: CHEBI:37563 name: CTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37565 name: GTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37568 name: dTTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37569 name: (+)-abscisate subset: chebi_ph7_3 is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:62071 ! 2-cis-abscisate [Term] id: CHEBI:37573 name: (2R)-DIMBOA glucoside subset: chebi_ph7_3 is_a: CHEBI:16603 ! DIMBOA glucoside [Term] id: CHEBI:37574 name: thiamine(1+) monophosphate(1-) is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:37575 name: thiamine(1+) monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37576 name: gallate ester is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:36054 ! benzoate ester [Term] id: CHEBI:37577 name: heteroatomic molecular entity is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:37578 name: halide is_a: CHEBI:24471 ! halogen molecular entity is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:37579 name: acyl halide is_a: CHEBI:37578 ! halide [Term] id: CHEBI:37581 name: gamma-lactone subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:37584 name: nicotinic acid dinucleotide is_a: CHEBI:25534 ! nicotinic acid nucleotide is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:37586 name: sodium phosphate is_a: CHEBI:190300 ! inorganic phosphate salt is_a: CHEBI:24838 ! inorganic phosphate is_a: CHEBI:38702 ! inorganic sodium salt [Term] id: CHEBI:37588 name: phosphonic acid derivative is_a: CHEBI:36359 ! phosphorus oxoacid derivative [Term] id: CHEBI:37592 name: organic phosphonate is_a: CHEBI:25710 ! organophosphorus compound is_a: CHEBI:26066 ! phosphonate [Term] id: CHEBI:37598 name: nitrogen mustard is_a: CHEBI:35352 ! organonitrogen compound relationship: has_role CHEBI:22333 ! alkylating agent [Term] id: CHEBI:37602 name: allenes subset: chebi_ph7_3 is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:37604 name: cis-octadec-9-ene subset: chebi_ph7_3 is_a: CHEBI:37605 ! octadec-9-ene [Term] id: CHEBI:37605 name: octadec-9-ene subset: chebi_ph7_3 is_a: CHEBI:37606 ! octadecene [Term] id: CHEBI:37606 name: octadecene is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:37607 name: trans-octadec-9-ene subset: chebi_ph7_3 is_a: CHEBI:37605 ! octadec-9-ene [Term] id: CHEBI:37610 name: cyclohexa-1,3-diene subset: chebi_ph7_3 is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:37611 name: cyclohexa-1,4-diene subset: chebi_ph7_3 is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:37613 name: cyclohexadiene is_a: CHEBI:36401 ! cycloalkadiene [Term] id: CHEBI:37614 name: alkenyl group is_a: CHEBI:33248 ! hydrocarbyl group [Term] id: CHEBI:37617 name: aldehydo-L-galactose subset: chebi_ph7_3 is_a: CHEBI:37618 ! L-galactose is_a: CHEBI:37662 ! aldehydo-galactose [Term] id: CHEBI:37618 name: L-galactose is_a: CHEBI:28260 ! galactose [Term] id: CHEBI:37619 name: L-galactopyranose subset: chebi_ph7_3 is_a: CHEBI:37618 ! L-galactose is_a: CHEBI:37621 ! galactopyranose [Term] id: CHEBI:37620 name: beta-L-galactose subset: chebi_ph7_3 is_a: CHEBI:37619 ! L-galactopyranose [Term] id: CHEBI:37621 name: galactopyranose is_a: CHEBI:28260 ! galactose [Term] id: CHEBI:37622 name: carboxamide subset: chebi_ph7_3 is_a: CHEBI:33256 ! primary amide is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36963 ! organooxygen compound relationship: has_part CHEBI:23004 ! carbamoyl group [Term] id: CHEBI:37623 name: 7alpha,25-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36864 ! 25-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37624 name: L-glucose is_a: CHEBI:17234 ! glucose [Term] id: CHEBI:37626 name: aldehydo-L-glucose subset: chebi_ph7_3 is_a: CHEBI:37624 ! L-glucose is_a: CHEBI:37663 ! aldehydo-glucose [Term] id: CHEBI:37627 name: L-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:37624 ! L-glucose is_a: CHEBI:37661 ! glucopyranose [Term] id: CHEBI:37630 name: alpha-L-glucose subset: chebi_ph7_3 is_a: CHEBI:37627 ! L-glucopyranose [Term] id: CHEBI:37631 name: beta-L-glucose subset: chebi_ph7_3 is_a: CHEBI:37627 ! L-glucopyranose [Term] id: CHEBI:37639 name: polysaccharide phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:37640 name: (24S)-7alpha,24-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:50517 ! 7alpha,24-dihydroxycholesterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37642 name: (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:15493 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA [Term] id: CHEBI:37643 name: (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl-CoA is_a: CHEBI:15493 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37645 name: luteolin 7-O-[(beta-D-glucosyluronic acid)-(1->2)-(beta-D-glucosiduronic acid)] 4'-O-beta-D-glucosiduronic acid is_a: CHEBI:25091 ! luteolin O-glucuronoside is_a: CHEBI:38686 ! dihydroxyflavone [Term] id: CHEBI:37646 name: 2-acyl-sn-glycero-3-phosphoserine is_a: CHEBI:68510 ! lysophosphatidylserine [Term] id: CHEBI:37649 name: purine ribonucleoside 2'-monophosphate is_a: CHEBI:26397 ! purine ribonucleoside monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate is_a: CHEBI:37650 ! ribonucleoside 2'-monophosphate [Term] id: CHEBI:37650 name: ribonucleoside 2'-monophosphate is_a: CHEBI:26558 ! ribonucleoside monophosphate is_a: CHEBI:53010 ! nucleoside 2'-phosphate [Term] id: CHEBI:37651 name: pyrimidine ribonucleoside 2'-monophosphate is_a: CHEBI:26443 ! pyrimidine ribonucleoside monophosphate is_a: CHEBI:37650 ! ribonucleoside 2'-monophosphate [Term] id: CHEBI:37653 name: phosphoerythronic acid is_a: CHEBI:49062 ! tetronic acid phosphate [Term] id: CHEBI:37654 name: erythronic acid is_a: CHEBI:49060 ! 2,3,4-trihydroxybutanoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37655 name: D-erythronic acid is_a: CHEBI:37654 ! erythronic acid [Term] id: CHEBI:37659 name: oleanolic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:3766 name: clozapine is_a: CHEBI:22720 ! benzodiazepine is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:46848 ! N-arylpiperazine is_a: CHEBI:46920 ! N-methylpiperazine relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:37887 ! adrenergic antagonist relationship: has_role CHEBI:37956 ! histamine antagonist relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:48876 ! muscarinic antagonist relationship: has_role CHEBI:65191 ! second generation antipsychotic relationship: has_role CHEBI:65259 ! GABA antagonist relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:37661 name: glucopyranose is_a: CHEBI:17234 ! glucose [Term] id: CHEBI:37662 name: aldehydo-galactose is_a: CHEBI:28260 ! galactose [Term] id: CHEBI:37663 name: aldehydo-glucose is_a: CHEBI:17234 ! glucose [Term] id: CHEBI:37667 name: sesquiterpene lactone is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:37668 ! terpene lactone [Term] id: CHEBI:37668 name: terpene lactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:37669 name: methanopterins is_a: CHEBI:26375 ! pterins is_a: CHEBI:36942 ! pterin phosphate [Term] id: CHEBI:37670 name: protease inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:37671 name: (1->3)-beta-D-glucan subset: chebi_ph7_3 is_a: CHEBI:28793 ! beta-D-glucan is_a: CHEBI:72813 ! exopolysaccharide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:37673 name: ajmalan is_a: CHEBI:38482 ! indole alkaloid fundamental parent is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:37674 name: 17-O-acetylajmaline is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:37676 name: L-mannose is_a: CHEBI:37684 ! mannose [Term] id: CHEBI:37677 name: L-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:37676 ! L-mannose is_a: CHEBI:37683 ! mannopyranose [Term] id: CHEBI:37679 name: beta-L-mannose subset: chebi_ph7_3 is_a: CHEBI:37677 ! L-mannopyranose [Term] id: CHEBI:37680 name: alpha-L-mannose subset: chebi_ph7_3 is_a: CHEBI:37677 ! L-mannopyranose [Term] id: CHEBI:37683 name: mannopyranose is_a: CHEBI:37684 ! mannose [Term] id: CHEBI:37684 name: mannose is_a: CHEBI:33917 ! aldohexose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:37690 name: allose is_a: CHEBI:33917 ! aldohexose relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37694 name: O-phospho peptide is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:37696 name: carbohydrate acid ester is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:37697 name: indolocarbazole alkaloid is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:51915 ! indolocarbazole [Term] id: CHEBI:37699 name: protein kinase inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:37700 name: EC 2.7.11.13 (protein kinase C) inhibitor is_a: CHEBI:76812 ! EC 2.7.11.* (protein-serine/threonine kinase) inhibitor [Term] id: CHEBI:37702 name: aldonate ester phosphate is_a: CHEBI:26816 ! carbohydrate phosphate [Term] id: CHEBI:37708 name: altrose is_a: CHEBI:33917 ! aldohexose [Term] id: CHEBI:37712 name: O-phosphoserine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:37713 name: O-phospho-D-serine is_a: CHEBI:37712 ! O-phosphoserine [Term] id: CHEBI:37721 name: D-fructofuranose subset: chebi_ph7_3 is_a: CHEBI:15824 ! D-fructose is_a: CHEBI:37722 ! fructofuranose [Term] id: CHEBI:37722 name: fructofuranose is_a: CHEBI:28757 ! fructose [Term] id: CHEBI:37723 name: keto-fructose is_a: CHEBI:28757 ! fructose [Term] id: CHEBI:37724 name: keto-L-fructose subset: chebi_ph7_3 is_a: CHEBI:28120 ! L-fructose is_a: CHEBI:37723 ! keto-fructose [Term] id: CHEBI:37725 name: L-fructofuranose subset: chebi_ph7_3 is_a: CHEBI:28120 ! L-fructose is_a: CHEBI:37722 ! fructofuranose [Term] id: CHEBI:37733 name: EC 3.1.1.8 (cholinesterase) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:37734 name: phosphoric ester is_a: CHEBI:26079 ! phosphoric acid derivative is_a: CHEBI:35701 ! ester [Term] id: CHEBI:37735 name: phosphonic ester is_a: CHEBI:35701 ! ester is_a: CHEBI:37588 ! phosphonic acid derivative [Term] id: CHEBI:37736 name: D-fructofuranose 1,6-bisphosphate is_a: CHEBI:78682 ! D-fructose 1,6-bisphosphate [Term] id: CHEBI:37737 name: 5-phospho-beta-D-ribosylamine is_a: CHEBI:17284 ! 5-phospho-D-ribosylamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:37738 name: undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide [Term] id: CHEBI:37739 name: glycerophospholipid is_a: CHEBI:16247 ! phospholipid is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:37740 name: beta-L-allose subset: chebi_ph7_3 is_a: CHEBI:37741 ! L-allopyranose [Term] id: CHEBI:37741 name: L-allopyranose subset: chebi_ph7_3 is_a: CHEBI:37742 ! allopyranose is_a: CHEBI:37747 ! L-allose [Term] id: CHEBI:37742 name: allopyranose is_a: CHEBI:37690 ! allose [Term] id: CHEBI:37746 name: aldehydo-L-allose subset: chebi_ph7_3 is_a: CHEBI:37747 ! L-allose is_a: CHEBI:37748 ! aldehydo-allose [Term] id: CHEBI:37747 name: L-allose is_a: CHEBI:37690 ! allose [Term] id: CHEBI:37748 name: aldehydo-allose is_a: CHEBI:37690 ! allose [Term] id: CHEBI:37749 name: halogen oxide is_a: CHEBI:24471 ! halogen molecular entity is_a: CHEBI:24836 ! inorganic oxide [Term] id: CHEBI:37750 name: chlorine oxide is_a: CHEBI:37749 ! halogen oxide [Term] id: CHEBI:37753 name: pseudooxynicotine is_a: CHEBI:26416 ! pyridine alkaloid is_a: CHEBI:38208 ! aminoacylpyridine [Term] id: CHEBI:37754 name: 6-hydroxypseudooxynicotine is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:37755 name: 4-(methylamino)butyric acid is_a: CHEBI:33707 ! gamma-amino acid [Term] id: CHEBI:37757 name: iodoalkane is_a: CHEBI:24469 ! haloalkane [Term] id: CHEBI:37763 name: elemental silicon is_a: CHEBI:26677 ! silicon molecular entity [Term] id: CHEBI:37773 name: organic phosphoramidate is_a: CHEBI:25703 ! organic phosphate [Term] id: CHEBI:37778 name: cycloartane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene [Term] id: CHEBI:37783 name: organosulfinic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:37784 ! sulfinic acid derivative is_a: CHEBI:64709 ! organic acid [Term] id: CHEBI:37784 name: sulfinic acid derivative is_a: CHEBI:33424 ! sulfur oxoacid derivative [Term] id: CHEBI:37785 name: organosulfinate oxoanion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:37786 name: acyclic phosphorus acid anhydride is_a: CHEBI:36608 ! acyclic acid anhydride [Term] id: CHEBI:37787 name: acyclic mixed acid anhydride is_a: CHEBI:36608 ! acyclic acid anhydride [Term] id: CHEBI:37788 name: O(4)-phospho-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:74956 ! O(4)-phosphotyrosine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:60816 ! immunogen relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:37793 name: amino sulfonic acid is_a: CHEBI:33551 ! organosulfonic acid is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:37794 name: aminosulfinic acid is_a: CHEBI:37783 ! organosulfinic acid [Term] id: CHEBI:37798 name: cyclic phosphorus acid anhydride is_a: CHEBI:36607 ! cyclic acid anhydride [Term] id: CHEBI:37806 name: penicillanic acid is_a: CHEBI:25865 ! penicillanic acids [Term] id: CHEBI:37808 name: butane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:78017 ! food propellant relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:37809 name: trans-dec-3-enoic acid is_a: CHEBI:61200 ! 3-decenoic acid [Term] id: CHEBI:37810 name: octadecatetraenoic acid is_a: CHEBI:132503 ! fatty acid 18:4 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36326 ! octadecanoid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:37812 name: dialkylglycerol is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76578 ! diradylglycerol [Term] id: CHEBI:37814 name: dialkylglycerophosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:37826 name: sulfuric acid derivative is_a: CHEBI:33424 ! sulfur oxoacid derivative [Term] id: CHEBI:37827 name: thiosulfuric acid derivative is_a: CHEBI:33424 ! sulfur oxoacid derivative [Term] id: CHEBI:37830 name: pentane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:37834 name: (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraene subset: chebi_ph7_3 is_a: CHEBI:37835 ! alkatetraene [Term] id: CHEBI:37835 name: alkatetraene is_a: CHEBI:33645 ! acyclic olefin [Term] id: CHEBI:37838 name: carboacyl group is_a: CHEBI:22221 ! acyl group [Term] id: CHEBI:37839 name: heterocyclyl sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester [Term] id: CHEBI:37840 name: hydroxyflavone sulfate is_a: CHEBI:37839 ! heterocyclyl sulfate [Term] id: CHEBI:37841 name: isoprenoid phosphate is_a: CHEBI:16247 ! phospholipid [Term] id: CHEBI:37846 name: imidazo[1,2-a]pyrazine subset: chebi_ph7_3 is_a: CHEBI:37847 ! imidazopyrazine is_a: CHEBI:38180 ! polycyclic heteroarene is_a: CHEBI:50893 ! azaarene [Term] id: CHEBI:37847 name: imidazopyrazine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:37848 name: plant hormone is_a: CHEBI:24621 ! hormone is_a: CHEBI:26155 ! plant growth regulator [Term] id: CHEBI:37853 name: phosphate salt is_a: CHEBI:26020 ! phosphate [Term] id: CHEBI:37858 name: sulfenic acid subset: chebi_ph7_3 is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:37859 name: sulfenate is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:37861 name: nucleotide-sugar sulfate is_a: CHEBI:35724 ! carbohydrate sulfate [Term] id: CHEBI:37862 name: O-sulfoamino acid is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester [Term] id: CHEBI:37863 name: chalcoperoxol is_a: CHEBI:36962 ! organochalcogen compound [Term] id: CHEBI:37864 name: thioperoxol is_a: CHEBI:37863 ! chalcoperoxol [Term] id: CHEBI:37868 name: octanol is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:197506 ! medium-chain fatty alcohol is_a: CHEBI:50584 ! alkyl alcohol [Term] id: CHEBI:37875 name: acyl sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:37876 name: O-acylglucosamine is_a: CHEBI:24271 ! glucosamines [Term] id: CHEBI:37878 name: glucosamine sulfate is_a: CHEBI:24585 ! hexosamine sulfate is_a: CHEBI:37876 ! O-acylglucosamine [Term] id: CHEBI:37886 name: adrenergic agonist is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:37887 name: adrenergic antagonist is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:37888 name: (1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:18340 ! cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid [Term] id: CHEBI:37889 name: (1S,6R)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid is_a: CHEBI:18340 ! cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid [Term] id: CHEBI:3789 name: cobalt-precorrin-6B is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:37890 name: alpha-adrenergic antagonist is_a: CHEBI:37887 ! adrenergic antagonist is_a: CHEBI:48539 ! alpha-adrenergic drug [Term] id: CHEBI:37898 name: tyrosyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:3790 name: cobalt-precorrin-2 is_a: CHEBI:25216 ! metalloporphyrin [Term] id: CHEBI:37902 name: methionyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:37903 name: lysyl group is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:37909 name: oligosaccharide sulfate is_a: CHEBI:35724 ! carbohydrate sulfate is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:3791 name: cobalt-precorrin-3 is_a: CHEBI:25216 ! metalloporphyrin [Term] id: CHEBI:37911 name: indane subset: chebi_ph7_3 is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon is_a: CHEBI:46940 ! indanes [Term] id: CHEBI:37912 name: hydroxycoumarin is_a: CHEBI:23403 ! coumarins [Term] id: CHEBI:37914 name: 27-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:37919 name: aryl sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:26819 ! sulfuric ester [Term] id: CHEBI:3792 name: cobalt-precorrin-4 is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:37921 name: pyridazines is_a: CHEBI:38313 ! diazines [Term] id: CHEBI:37930 name: phenothiazine antipsychotic drug is_a: CHEBI:65190 ! first generation antipsychotic [Term] id: CHEBI:37931 name: 10H-phenothiazine subset: chebi_ph7_3 is_a: CHEBI:37932 ! phenothiazine relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:37932 name: phenothiazine is_a: CHEBI:36416 ! mancude organic heterotricyclic parent is_a: CHEBI:38093 ! phenothiazines [Term] id: CHEBI:37933 name: 4aH-phenothiazine subset: chebi_ph7_3 is_a: CHEBI:37932 ! phenothiazine [Term] id: CHEBI:37934 name: 1H-phenothiazine subset: chebi_ph7_3 is_a: CHEBI:37932 ! phenothiazine [Term] id: CHEBI:37935 name: 3H-phenothiazine subset: chebi_ph7_3 is_a: CHEBI:37932 ! phenothiazine [Term] id: CHEBI:3794 name: cobalt-precorrin-6A is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:37941 name: clopidogrel subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:37942 ! thienopyridine is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:68563 ! P2Y12 receptor antagonist [Term] id: CHEBI:37942 name: thienopyridine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:37944 name: polysaccharide sulfate is_a: CHEBI:35724 ! carbohydrate sulfate is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:37947 name: benzothiazoles is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:37948 name: oxaspiro compound is_a: CHEBI:33599 ! spiro compound [Term] id: CHEBI:37949 name: azacycloalkane is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:3795 name: cobalt-precorrin-8 is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:37955 name: H1-receptor antagonist is_a: CHEBI:37956 ! histamine antagonist [Term] id: CHEBI:37956 name: histamine antagonist is_a: CHEBI:37957 ! histaminergic drug is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:37957 name: histaminergic drug is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:37958 name: dye is_a: CHEBI:33232 ! application [Term] id: CHEBI:37962 name: adrenergic agent is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:37963 name: pyranone is_a: CHEBI:26407 ! pyrans [Term] id: CHEBI:37965 name: 2H-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:37986 name: 1-(3-O-sulfo-beta-D-galactosyl-(1->4)-beta-D-glucosyl)-N-acylsphingosine is_a: CHEBI:36477 ! sulfoglycosphingolipid is_a: CHEBI:63415 ! glycodiaosylceramide [Term] id: CHEBI:37996 name: organic thiosulfate is_a: CHEBI:26977 ! thiosulfate [Term] id: CHEBI:37997 name: homopolymer macromolecule is_a: CHEBI:33839 ! macromolecule [Term] id: CHEBI:37998 name: glycolithocholic acid is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:36255 ! bile acid glycine conjugate [Term] id: CHEBI:38001 name: 2,6-diaminopurines is_a: CHEBI:22527 ! aminopurine [Term] id: CHEBI:38023 name: 3-sulfolactic acid is_a: CHEBI:38031 ! carboxyalkanesulfonic acid [Term] id: CHEBI:38024 name: carboxyalkyl sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:33576 ! sulfur-containing carboxylic acid [Term] id: CHEBI:38028 name: cyanuric acid subset: chebi_ph7_3 is_a: CHEBI:26588 ! 1,3,5-triazines is_a: CHEBI:74818 ! heteroaryl hydroxy compound relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:38029 name: carbohydrate sulfonate is_a: CHEBI:33551 ! organosulfonic acid is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:38031 name: carboxyalkanesulfonic acid is_a: CHEBI:33551 ! organosulfonic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid [Term] id: CHEBI:38032 name: carbotricyclic compound is_a: CHEBI:35294 ! carbopolycyclic compound is_a: CHEBI:51959 ! organic tricyclic compound [Term] id: CHEBI:38033 name: acenaphthylenes is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:38034 name: aminonaphthalene is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:33860 ! aromatic amine [Term] id: CHEBI:38036 name: sulfobenzoate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:38038 name: sulfuric amide is_a: CHEBI:37826 ! sulfuric acid derivative [Term] id: CHEBI:38060 name: triazine insecticide is_a: CHEBI:24852 ! insecticide [Term] id: CHEBI:38063 name: quinolizines is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38068 name: antimalarial is_a: CHEBI:64915 ! antiplasmodial drug [Term] id: CHEBI:38070 name: anti-arrhythmia drug is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:38071 name: 1,3,5-triazine-2,4-diamine subset: chebi_ph7_3 is_a: CHEBI:38170 ! diamino-1,3,5-triazine [Term] id: CHEBI:38074 name: 2-chloro-1,3,5-triazine subset: chebi_ph7_3 is_a: CHEBI:38168 ! chloro-1,3,5-triazine [Term] id: CHEBI:38077 name: polypyrrole is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38084 name: sulfoximide is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:38089 name: 15-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:38090 name: 15beta-hydroxy steroid is_a: CHEBI:38089 ! 15-hydroxy steroid [Term] id: CHEBI:38091 name: spirostanyl glycoside is_a: CHEBI:61655 ! steroid saponin [Term] id: CHEBI:38093 name: phenothiazines is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:38101 name: organonitrogen heterocyclic compound is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:38102 name: triazines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:50893 ! azaarene [Term] id: CHEBI:38104 name: oxacycle is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:38106 name: organosulfur heterocyclic compound is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:38107 name: trans-4-carboxymethylenebut-2-en-4-olide is_a: CHEBI:11972 ! 4-carboxymethylenebut-2-en-4-olide [Term] id: CHEBI:38108 name: azetidine-2-carboxylic acid is_a: CHEBI:33709 ! amino acid is_a: CHEBI:46891 ! azetidinecarboxylic acid relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:38109 name: (R)-azetidine-2-carboxylic acid is_a: CHEBI:38108 ! azetidine-2-carboxylic acid [Term] id: CHEBI:38111 name: benzoindole is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38113 name: (R,R,R)-nicotianamine is_a: CHEBI:25520 ! nicotianamine [Term] id: CHEBI:38118 name: but-2-en-4-olide subset: chebi_ph7_3 is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:38120 name: but-3-en-4-olide subset: chebi_ph7_3 is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:38122 name: 2-chloro-4-carboxymethylenebut-2-en-1,4-olide is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:38124 name: dialdehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:38131 name: lactol is_a: CHEBI:5653 ! hemiacetal [Term] id: CHEBI:38132 name: indanone is_a: CHEBI:24789 ! indanones [Term] id: CHEBI:38133 name: naphthalenediol is_a: CHEBI:23783 ! naphthalenediols [Term] id: CHEBI:38139 name: (1S,2R)-1,2-dihydronaphthalene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:15561 ! cis-1,2-dihydronaphthalene-1,2-diol [Term] id: CHEBI:38141 name: dihydronaphthalene is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon is_a: CHEBI:90740 ! dihydronaphthalenes [Term] id: CHEBI:38142 name: 1,2-dihydronaphthalene subset: chebi_ph7_3 is_a: CHEBI:38141 ! dihydronaphthalene [Term] id: CHEBI:38147 name: cardiotonic drug is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:38149 name: 19-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:38150 name: enterobactin(6-) is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:26672 ! siderophore [Term] id: CHEBI:38151 name: ferrienterobactin is_a: CHEBI:84734 ! Fe(III)-complexed siderophore [Term] id: CHEBI:38155 name: phytosiderophore is_a: CHEBI:24028 ! iron(3+) chelator is_a: CHEBI:24874 ! iron ionophore [Term] id: CHEBI:38157 name: iron chelator is_a: CHEBI:38161 ! chelator [Term] id: CHEBI:38159 name: 3-epi-3-hydroxy-2'-deoxymugineic acid is_a: CHEBI:25427 ! mugineic acids [Term] id: CHEBI:38160 name: 3''-deamino-3''-oxonicotianamine is_a: CHEBI:25427 ! mugineic acids [Term] id: CHEBI:38161 name: chelator is_a: CHEBI:52214 ! ligand [Term] id: CHEBI:38163 name: organic heterotetracyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:38164 name: organic heteropentacyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:38165 name: organic heterooctacyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:38166 name: organic heteropolycyclic compound is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:33671 ! heteropolycyclic compound [Term] id: CHEBI:38168 name: chloro-1,3,5-triazine is_a: CHEBI:26588 ! 1,3,5-triazines is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:38169 name: monoamino-1,3,5-triazine is_a: CHEBI:26588 ! 1,3,5-triazines [Term] id: CHEBI:38170 name: diamino-1,3,5-triazine is_a: CHEBI:23666 ! diamine is_a: CHEBI:26588 ! 1,3,5-triazines [Term] id: CHEBI:38172 name: monohydroxy-1,3,5-triazine is_a: CHEBI:26588 ! 1,3,5-triazines [Term] id: CHEBI:38173 name: dihydroxy-1,3,5-triazine is_a: CHEBI:26588 ! 1,3,5-triazines [Term] id: CHEBI:38175 name: triamino-1,3,5-triazine is_a: CHEBI:26588 ! 1,3,5-triazines [Term] id: CHEBI:38179 name: monocyclic heteroarene is_a: CHEBI:33833 ! heteroarene [Term] id: CHEBI:38180 name: polycyclic heteroarene is_a: CHEBI:33833 ! heteroarene [Term] id: CHEBI:38181 name: pyridinemonocarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38182 name: monohydroxypyridine is_a: CHEBI:24745 ! hydroxypyridine [Term] id: CHEBI:38183 name: pyridone is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:38184 name: picolinate subset: chebi_ph7_3 is_a: CHEBI:38181 ! pyridinemonocarboxylate [Term] id: CHEBI:38186 name: isonicotinate subset: chebi_ph7_3 is_a: CHEBI:38181 ! pyridinemonocarboxylate [Term] id: CHEBI:38187 name: pyridinecarbaldehyde is_a: CHEBI:26421 ! pyridines is_a: CHEBI:49104 ! heteroarenecarbaldehyde [Term] id: CHEBI:38188 name: pyridinium salt is_a: CHEBI:24868 ! organic salt is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:38189 name: pyridine N-oxides is_a: CHEBI:26421 ! pyridines is_a: CHEBI:35580 ! N-oxide [Term] id: CHEBI:38194 name: 5alpha-hydroxy steroid is_a: CHEBI:36848 ! 5-hydroxy steroid [Term] id: CHEBI:38196 name: hydroxymethylpyridine is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:38197 name: furopyridine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38198 name: aminoalkylpyridine is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:38201 name: bacteriochlorophyll subset: chebi_ph7_3 is_a: CHEBI:28966 ! chlorophyll [Term] id: CHEBI:38206 name: chlorophyllide is_a: CHEBI:28966 ! chlorophyll [Term] id: CHEBI:38208 name: aminoacylpyridine is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:38209 name: chlorophyllide b is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:38215 name: calcium channel blocker is_a: CHEBI:38808 ! calcium channel modulator is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:38221 name: fumonisin B1 is_a: CHEBI:27136 ! triol is_a: CHEBI:38224 ! fumonisin is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:38222 name: hydrocarbyl anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:38224 name: fumonisin is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35742 ! tetracarboxylic acid relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:38226 name: 1,2-dithiolane subset: chebi_ph7_3 is_a: CHEBI:38335 ! dithiolane [Term] id: CHEBI:38229 name: solanapyrone A subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:38230 ! solanapyrone is_a: CHEBI:38332 ! pyrancarbaldehyde relationship: has_role CHEBI:131699 ! EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor [Term] id: CHEBI:38230 name: solanapyrone is_a: CHEBI:75885 ! 2-pyranones relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:38231 name: phytotoxin is_a: CHEBI:27026 ! toxin is_a: CHEBI:76924 ! plant metabolite [Term] id: CHEBI:38234 name: DNA polymerase inhibitor is_a: CHEBI:76815 ! EC 2.7.7.* (nucleotidyltransferase) inhibitor [Term] id: CHEBI:38237 name: prosolanapyrone is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:38238 name: prosolanapyrone II subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38237 ! prosolanapyrone [Term] id: CHEBI:38247 name: (R)-3-hydroxypalmitic acid is_a: CHEBI:37248 ! 3-hydroxypalmitic acid is_a: CHEBI:85678 ! (3R)-3-hydroxy fatty acid [Term] id: CHEBI:38249 name: (1S,4R)-1-hydroxylimonen-2-one subset: chebi_ph7_3 is_a: CHEBI:50246 ! 1-hydroxylimonen-2-one [Term] id: CHEBI:38251 name: magnesium tetrapyrrole is_a: CHEBI:33909 ! metallotetrapyrrole is_a: CHEBI:33976 ! magnesium coordination entity [Term] id: CHEBI:38252 name: phorbines is_a: CHEBI:36309 ! cyclic tetrapyrrole [Term] id: CHEBI:38254 name: pheophorbide is_a: CHEBI:38252 ! phorbines [Term] id: CHEBI:38257 name: pheophorbide a is_a: CHEBI:38254 ! pheophorbide [Term] id: CHEBI:38259 name: divinyl chlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:38260 name: pyrrolidines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38261 name: imidazolidines is_a: CHEBI:38304 ! diazolidine [Term] id: CHEBI:38262 name: allothreonine is_a: CHEBI:38263 ! 2-amino-3-hydroxybutanoic acid [Term] id: CHEBI:38263 name: 2-amino-3-hydroxybutanoic acid is_a: CHEBI:33704 ! alpha-amino acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:38264 name: 2-amino-3-methylpentanoic acid is_a: CHEBI:22918 ! branched-chain amino acid is_a: CHEBI:33704 ! alpha-amino acid [Term] id: CHEBI:38265 name: carvone subset: chebi_ph7_3 is_a: CHEBI:23048 ! carvones is_a: CHEBI:86494 ! botanical anti-fungal agent relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:38266 name: O-beta-D-glucosyl-trans-zeatin subset: chebi_ph7_3 is_a: CHEBI:38646 ! O-beta-D-glucosylzeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:38275 name: pyrrolidinone is_a: CHEBI:38260 ! pyrrolidines [Term] id: CHEBI:3828 name: (R)-columbianetin subset: chebi_ph7_3 is_a: CHEBI:59948 ! columbianetin [Term] id: CHEBI:38290 name: L-ascorbate subset: chebi_ph7_3 is_a: CHEBI:176783 ! vitamin C is_a: CHEBI:22651 ! ascorbate relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:38291 name: dihydrostreptomycin is_a: CHEBI:26788 ! streptomycins [Term] id: CHEBI:38295 name: azabicycloalkane is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38297 name: thiabicycloalkane is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:38298 name: benzodioxoles is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38299 name: vernolic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:72659 ! epoxyoctadecenoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:3830 name: camphene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:38303 name: azirinopyrroloindole is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:38304 name: diazolidine is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38305 name: gibberellin monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:38306 name: imidazole-4-carboxylic acid is_a: CHEBI:38307 ! imidazolyl carboxylic acid [Term] id: CHEBI:38307 name: imidazolyl carboxylic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:33859 ! aromatic carboxylic acid [Term] id: CHEBI:38308 name: N-acylimidazole is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:38311 name: cephem is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:27933 ! beta-lactam antibiotic is_a: CHEBI:35627 ! beta-lactam is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:38313 name: diazines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38314 name: pyrazines is_a: CHEBI:38313 ! diazines [Term] id: CHEBI:38315 name: beta-D-arabinoside is_a: CHEBI:22601 ! arabinoside [Term] id: CHEBI:38316 name: pyrimidinecarboxylate anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38317 name: EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:38319 name: usnic acid is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38922 ! dibenzofurans is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:78361 ! lichen metabolite [Term] id: CHEBI:38320 name: (+)-usnic acid is_a: CHEBI:38319 ! usnic acid [Term] id: CHEBI:38323 name: cholinergic drug is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:38324 name: cholinergic agonist is_a: CHEBI:38323 ! cholinergic drug [Term] id: CHEBI:38325 name: muscarinic agonist is_a: CHEBI:38324 ! cholinergic agonist [Term] id: CHEBI:38326 name: thiazine is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:38329 name: oxazolidines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38331 name: 11-tetradecenoic acid is_a: CHEBI:36004 ! tetradecenoic acid [Term] id: CHEBI:38332 name: pyrancarbaldehyde is_a: CHEBI:26407 ! pyrans [Term] id: CHEBI:38333 name: thiazolidine is_a: CHEBI:35622 ! thiazolidines is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent [Term] id: CHEBI:38335 name: dithiolane is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:38106 ! organosulfur heterocyclic compound is_a: CHEBI:39192 ! dithiolanes [Term] id: CHEBI:38336 name: dithiolanecarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:39192 ! dithiolanes [Term] id: CHEBI:38337 name: pyrimidone is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:38338 name: aminopyrimidine is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:38339 name: formamidopyrimidine is_a: CHEBI:24079 ! formamides is_a: CHEBI:48536 ! amidopyrimidine [Term] id: CHEBI:38340 name: hydroxypyrimidine is_a: CHEBI:39447 ! pyrimidines is_a: CHEBI:74818 ! heteroaryl hydroxy compound [Term] id: CHEBI:38342 name: L-sorbose 1-phosphate is_a: CHEBI:28173 ! sorbose 1-phosphate relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:38355 name: hex-4-enoic acid is_a: CHEBI:24580 ! hexenoic acid [Term] id: CHEBI:38356 name: trans-hex-4-enoic acid is_a: CHEBI:38355 ! hex-4-enoic acid [Term] id: CHEBI:38358 name: (2E,4E)-hexa-2,4-dienoic acid is_a: CHEBI:35962 ! sorbic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:38371 name: 2-dodecenoic acid is_a: CHEBI:23867 ! dodecenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:38373 name: 3-dodecenoic acid is_a: CHEBI:23867 ! dodecenoic acid [Term] id: CHEBI:38382 name: 9,11,13-octadecatrienoic acid is_a: CHEBI:61160 ! conjugated linolenic acid [Term] id: CHEBI:38387 name: 9,11,15-octadecatrienoic acid is_a: CHEBI:25633 ! octadecatrienoic acid [Term] id: CHEBI:38390 name: 9,11,15-octadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:36434 ! octadecatrienoate [Term] id: CHEBI:38393 name: octadeca-9,11-dienoate subset: chebi_ph7_3 is_a: CHEBI:25626 ! octadecadienoate [Term] id: CHEBI:38407 name: muconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:24553 ! hexadienedioic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:38408 name: chloromuconic acid is_a: CHEBI:36685 ! chlorocarboxylic acid [Term] id: CHEBI:38409 name: 2,4-dichloromuconic acid is_a: CHEBI:38422 ! dichloromuconic acid [Term] id: CHEBI:38411 name: chlorocarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:38412 name: 2,4-dichloromuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38424 ! dichloromuconate(2-) [Term] id: CHEBI:38418 name: 1,3-thiazoles is_a: CHEBI:48901 ! thiazoles [Term] id: CHEBI:38419 name: saturated organic heterobicyclic parent is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:36388 ! saturated organic heterocyclic parent [Term] id: CHEBI:38421 name: 2,5-dichloromuconic acid is_a: CHEBI:38422 ! dichloromuconic acid [Term] id: CHEBI:38422 name: dichloromuconic acid is_a: CHEBI:38408 ! chloromuconic acid [Term] id: CHEBI:38424 name: dichloromuconate(2-) is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion is_a: CHEBI:38411 ! chlorocarboxylic acid anion [Term] id: CHEBI:38425 name: 2,5-dichloromuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38424 ! dichloromuconate(2-) [Term] id: CHEBI:38426 name: (2E,4Z)-5-carboxy-2,4,5-trichloropenta-2,4-dienoate is_a: CHEBI:38427 ! 2,3,5-trichloro-cis,cis-muconate(1-) [Term] id: CHEBI:38427 name: 2,3,5-trichloro-cis,cis-muconate(1-) is_a: CHEBI:38411 ! chlorocarboxylic acid anion [Term] id: CHEBI:38428 name: 3-chloromuconic acid is_a: CHEBI:38429 ! monochloromuconic acid [Term] id: CHEBI:38429 name: monochloromuconic acid is_a: CHEBI:38408 ! chloromuconic acid [Term] id: CHEBI:38434 name: 2-chloromuconic acid is_a: CHEBI:38429 ! monochloromuconic acid [Term] id: CHEBI:38436 name: muconic semialdehyde is_a: CHEBI:26643 ! aldehydic acid [Term] id: CHEBI:38439 name: N-acetyl-D-glucosaminate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:38443 name: 1-benzopyran is_a: CHEBI:22727 ! benzopyran [Term] id: CHEBI:38444 name: 2-benzopyran is_a: CHEBI:22727 ! benzopyran [Term] id: CHEBI:38445 name: chromenone is_a: CHEBI:23232 ! chromenes [Term] id: CHEBI:38448 name: trichloromuconic acid is_a: CHEBI:38408 ! chloromuconic acid [Term] id: CHEBI:38459 name: oxindoles is_a: CHEBI:24829 ! indolones is_a: CHEBI:74222 ! gamma-lactam [Term] id: CHEBI:38460 name: methylindole is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:38462 name: EC 3.1.1.7 (acetylcholinesterase) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:38466 name: imidazolyl carboxylic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38467 name: indolyl alcohol is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:38468 name: indol-3-yl carboxylic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38472 name: acetonitrile subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:80291 ! aliphatic nitrile relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:77941 ! EC 3.5.1.4 (amidase) inhibitor [Term] id: CHEBI:38481 name: alkaloid ester is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:38482 name: indole alkaloid fundamental parent is_a: CHEBI:35506 ! alkaloid fundamental parent [Term] id: CHEBI:38484 name: ergoline is_a: CHEBI:23666 ! diamine is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38482 ! indole alkaloid fundamental parent is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:60529 ! ergoline alkaloid [Term] id: CHEBI:38496 name: electron-transport chain inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:38497 name: respiratory-chain inhibitor is_a: CHEBI:38496 ! electron-transport chain inhibitor [Term] id: CHEBI:38498 name: mitochondrial NADH:ubiquinone reductase inhibitor is_a: CHEBI:25355 ! mitochondrial respiratory-chain inhibitor is_a: CHEBI:38503 ! EC 1.6.5.3 [NADH:ubiquinone reductase (H(+)-translocating)] inhibitor [Term] id: CHEBI:38500 name: EC 1.9.3.1 (cytochrome c oxidase) inhibitor is_a: CHEBI:25355 ! mitochondrial respiratory-chain inhibitor is_a: CHEBI:76870 ! EC 1.9.3.* (oxidoreductase acting on donor heme group, oxygen as acceptor) inhibitor [Term] id: CHEBI:38503 name: EC 1.6.5.3 [NADH:ubiquinone reductase (H(+)-translocating)] inhibitor is_a: CHEBI:38497 ! respiratory-chain inhibitor is_a: CHEBI:76866 ! EC 1.6.5.* (oxidoreductase acting on NADH or NADPH with a quinone or similar as acceptor) inhibitor [Term] id: CHEBI:38506 name: 2-isopropylphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:38512 name: dibenzoquinolizine is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38515 name: isoquinoline alkaloid fundamental parent is_a: CHEBI:35506 ! alkaloid fundamental parent [Term] id: CHEBI:38517 name: benzophenanthridine alkaloid is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:38518 ! benzophenanthridine [Term] id: CHEBI:38518 name: benzophenanthridine is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:38521 name: pyrrolizine alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:38522 ! pyrrolizines [Term] id: CHEBI:38522 name: pyrrolizines is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38526 name: quinolizidine alkaloid fundamental parent is_a: CHEBI:35506 ! alkaloid fundamental parent [Term] id: CHEBI:38530 name: quinazolines is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38532 name: hydrazone is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:38560 name: simple protein is_a: CHEBI:36080 ! protein [Term] id: CHEBI:38573 name: ferroheme is_a: CHEBI:30413 ! heme [Term] id: CHEBI:38574 name: ferriheme is_a: CHEBI:30413 ! heme [Term] id: CHEBI:38579 name: peptide pheromone is_a: CHEBI:16670 ! peptide relationship: has_role CHEBI:26013 ! pheromone [Term] id: CHEBI:38582 name: difluorobenzene is_a: CHEBI:35496 ! fluorobenzenes [Term] id: CHEBI:38584 name: 1,3-difluorobenzene subset: chebi_ph7_3 is_a: CHEBI:38582 ! difluorobenzene [Term] id: CHEBI:38595 name: 3H-pyrazole subset: chebi_ph7_3 is_a: CHEBI:14973 ! pyrazole [Term] id: CHEBI:38596 name: pyrazolide is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:38597 name: triazole is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:35727 ! triazoles is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:38599 name: 4H-pyrazole subset: chebi_ph7_3 is_a: CHEBI:14973 ! pyrazole [Term] id: CHEBI:38600 name: 4H-pyrazol-4-ide is_a: CHEBI:38596 ! pyrazolide [Term] id: CHEBI:38605 name: phenethylamine alkaloid is_a: CHEBI:22315 ! alkaloid [Term] id: CHEBI:38606 name: cyclopentapyran is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38607 name: dibenzazecine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38608 name: dibenzazecine alkaloid is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:38607 ! dibenzazecine [Term] id: CHEBI:38609 name: indolecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38615 name: cyclopiazonic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:38275 ! pyrrolidinone relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:38623 name: EC 1.4.3.4 (monoamine oxidase) inhibitor is_a: CHEBI:76861 ! EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor [Term] id: CHEBI:38631 name: aminoalkylindole is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:38632 name: membrane transport modulator is_a: CHEBI:52208 ! biophysical role [Term] id: CHEBI:38633 name: sodium channel blocker is_a: CHEBI:39000 ! sodium channel modulator [Term] id: CHEBI:38634 name: voltage-gated sodium channel blocker is_a: CHEBI:38633 ! sodium channel blocker [Term] id: CHEBI:38637 name: tyrosine kinase inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor [Term] id: CHEBI:38643 name: 6-isopentenylaminopurine is_a: CHEBI:22527 ! aminopurine [Term] id: CHEBI:38644 name: O-beta-D-glucosylzeatins is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:38645 name: N-glycosylzeatin is_a: CHEBI:21731 ! N-glycosyl compound [Term] id: CHEBI:38646 name: O-beta-D-glucosylzeatin is_a: CHEBI:24289 ! glucosyl-N(6)-isopentenyladenine is_a: CHEBI:38644 ! O-beta-D-glucosylzeatins [Term] id: CHEBI:38653 name: methylbutyric acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:38655 name: (S)-2-methylbutyric acid is_a: CHEBI:37070 ! 2-methylbutyric acid [Term] id: CHEBI:38656 name: organochlorine pesticide is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:25944 ! pesticide [Term] id: CHEBI:38667 name: purinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:38668 name: purinecarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38670 name: pyrrolopyrimidine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38672 name: flavans subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:38443 ! 1-benzopyran is_a: CHEBI:47916 ! flavonoid [Term] id: CHEBI:38674 name: chromenemonocarboxylate is_a: CHEBI:23232 ! chromenes is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38679 name: fluorobiphenyl is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:38684 name: tetrahydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:38685 name: 1,2-epoxypropane subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide [Term] id: CHEBI:38686 name: dihydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:38687 name: monohydroxyflavone is_a: CHEBI:24698 ! hydroxyflavone [Term] id: CHEBI:38691 name: flavan subset: chebi_ph7_3 is_a: CHEBI:38672 ! flavans [Term] id: CHEBI:38695 name: anthocyanidin is_a: CHEBI:47916 ! flavonoid relationship: has_part CHEBI:16366 ! anthocyanidin cation [Term] id: CHEBI:38697 name: anthocyanin is_a: CHEBI:25697 ! organic cation is_a: CHEBI:47916 ! flavonoid relationship: has_part CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:38702 name: inorganic sodium salt is_a: CHEBI:24839 ! inorganic salt is_a: CHEBI:26714 ! sodium salt [Term] id: CHEBI:38706 name: pediculicide is_a: CHEBI:24852 ! insecticide [Term] id: CHEBI:38716 name: carboxylic acid dianion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:38717 name: carboxylic acid trianion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:38738 name: monomethoxyflavanone is_a: CHEBI:25240 ! methoxyflavanone [Term] id: CHEBI:38739 name: trihydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38740 name: isoflavan subset: chebi_ph7_3 is_a: CHEBI:72572 ! isoflavans [Term] id: CHEBI:38741 name: isoflavanones subset: chebi_ph7_3 is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:72572 ! isoflavans [Term] id: CHEBI:38742 name: tetrahydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38744 name: hexahydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38745 name: pentahydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38747 name: taxifolin subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:38745 ! pentahydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones is_a: CHEBI:48039 ! dihydroflavonols [Term] id: CHEBI:38748 name: monohydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38749 name: dihydroxyflavanone is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:38751 name: triamine is_a: CHEBI:88061 ! polyamine [Term] id: CHEBI:38755 name: hydroxyisoflavone is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:38757 ! isoflavones [Term] id: CHEBI:38756 name: methoxyisoflavone is_a: CHEBI:25698 ! ether is_a: CHEBI:38757 ! isoflavones [Term] id: CHEBI:38757 name: isoflavones subset: chebi_ph7_3 is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:50753 ! isoflavonoid [Term] id: CHEBI:38758 name: isocoumarins is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:38761 ! isochromenes [Term] id: CHEBI:38759 name: isocoumarin subset: chebi_ph7_3 is_a: CHEBI:38758 ! isocoumarins [Term] id: CHEBI:38760 name: mellein subset: chebi_ph7_3 is_a: CHEBI:38762 ! isochromanes [Term] id: CHEBI:38761 name: isochromenes is_a: CHEBI:38444 ! 2-benzopyran [Term] id: CHEBI:38762 name: isochromanes is_a: CHEBI:38444 ! 2-benzopyran [Term] id: CHEBI:38763 name: chromanone is_a: CHEBI:23230 ! chromanes is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:38767 name: benzothiophenes is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:38773 name: quinolinemonocarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38774 name: hydroxyquinoline is_a: CHEBI:26513 ! quinolines [Term] id: CHEBI:38775 name: monohydroxyquinoline is_a: CHEBI:38774 ! hydroxyquinoline [Term] id: CHEBI:38777 name: azetidines is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38778 name: triazinanes is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38779 name: 1,3,5-triazinanes is_a: CHEBI:38778 ! triazinanes [Term] id: CHEBI:38784 name: oxetanes is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38785 name: morpholines is_a: CHEBI:46952 ! oxazinane [Term] id: CHEBI:38793 name: pteroate is_a: CHEBI:38796 ! pteroates [Term] id: CHEBI:38794 name: pteroic acid is_a: CHEBI:38795 ! pteroic acids [Term] id: CHEBI:38795 name: pteroic acids is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:38796 name: pteroates is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:38797 name: dihydropterin is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:38807 name: calcium channel agonist is_a: CHEBI:38808 ! calcium channel modulator [Term] id: CHEBI:38808 name: calcium channel modulator is_a: CHEBI:38632 ! membrane transport modulator [Term] id: CHEBI:38809 name: ryanodine receptor modulator is_a: CHEBI:38808 ! calcium channel modulator [Term] id: CHEBI:38818 name: N-methylcoclaurine is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline [Term] id: CHEBI:38824 name: fluorocarbon is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:38825 name: tetrafluoromethane subset: chebi_ph7_3 is_a: CHEBI:38824 ! fluorocarbon is_a: CHEBI:39281 ! fluoromethanes relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:38828 name: nonionic surfactant is_a: CHEBI:35195 ! surfactant [Term] id: CHEBI:38830 name: 1-benzofurans is_a: CHEBI:35259 ! benzofurans [Term] id: CHEBI:38831 name: 2-benzofurans is_a: CHEBI:35259 ! benzofurans [Term] id: CHEBI:38834 name: benzofurochromene is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:38835 name: xanthenes is_a: CHEBI:39203 ! dibenzopyran [Term] id: CHEBI:38836 name: 1-benzothiophenes is_a: CHEBI:38767 ! benzothiophenes [Term] id: CHEBI:38846 name: phenoxyacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:38853 name: decalin subset: chebi_ph7_3 is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon relationship: has_role CHEBI:46787 ! solvent [Term] id: CHEBI:38856 name: halophenol is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:38863 name: trans-decalin subset: chebi_ph7_3 is_a: CHEBI:38853 ! decalin [Term] id: CHEBI:38867 name: anaesthetic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:38869 name: general anaesthetic is_a: CHEBI:38867 ! anaesthetic [Term] id: CHEBI:38870 name: inhalation anaesthetic is_a: CHEBI:38869 ! general anaesthetic [Term] id: CHEBI:38877 name: intravenous anaesthetic is_a: CHEBI:38869 ! general anaesthetic [Term] id: CHEBI:38884 name: diphenylmethane subset: chebi_ph7_3 is_a: CHEBI:51614 ! diarylmethane [Term] id: CHEBI:3892 name: corticotropin is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:25905 ! peptide hormone is_a: CHEBI:33694 ! biomacromolecule relationship: has_role CHEBI:33295 ! diagnostic agent [Term] id: CHEBI:38920 name: benzochromene is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38922 name: dibenzofurans is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:38925 name: benzopteridine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:38932 name: pyridopyrimidine is_a: CHEBI:27171 ! organic heterobicyclic compound [Term] id: CHEBI:38933 name: 3-aminopropane-1-thiol is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:38934 name: purvalanol is_a: CHEBI:38001 ! 2,6-diaminopurines [Term] id: CHEBI:38941 name: schistosomicide drug is_a: CHEBI:35684 ! antiplatyhelmintic drug [Term] id: CHEBI:38956 name: ectoparasiticide is_a: CHEBI:35442 ! antiparasitic agent [Term] id: CHEBI:38958 name: indole alkaloid is_a: CHEBI:22315 ! alkaloid relationship: has_part CHEBI:73398 ! indole skeleton [Term] id: CHEBI:38975 name: methylbenzene is_a: CHEBI:38976 ! alkylbenzene [Term] id: CHEBI:38976 name: alkylbenzene is_a: CHEBI:22712 ! benzenes is_a: CHEBI:33847 ! monocyclic arene [Term] id: CHEBI:38999 name: GABA-gated chloride channel antagonist is_a: CHEBI:38632 ! membrane transport modulator is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:3900 name: costunolide subset: chebi_ph7_3 is_a: CHEBI:33672 ! heterobicyclic compound is_a: CHEBI:73011 ! germacranolide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35442 ! antiparasitic agent relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:36044 ! antiviral drug [Term] id: CHEBI:39000 name: sodium channel modulator is_a: CHEBI:38632 ! membrane transport modulator [Term] id: CHEBI:39015 name: apolipoprotein is_a: CHEBI:13850 ! apoprotein [Term] id: CHEBI:39022 name: inclusion compound is_a: CHEBI:50967 ! non-covalently-bound molecular entity [Term] id: CHEBI:39024 name: clathrate compound is_a: CHEBI:39022 ! inclusion compound [Term] id: CHEBI:39025 name: high-density lipoprotein is_a: CHEBI:6495 ! lipoprotein relationship: has_part CHEBI:47775 ! high-density lipoprotein cholesterol [Term] id: CHEBI:39026 name: low-density lipoprotein is_a: CHEBI:6495 ! lipoprotein relationship: has_part CHEBI:47774 ! low-density lipoprotein cholesterol [Term] id: CHEBI:39027 name: very-low-density lipoprotein is_a: CHEBI:6495 ! lipoprotein relationship: has_part CHEBI:47773 ! very-low-density lipoprotein cholesterol relationship: has_part CHEBI:47776 ! very-low-density lipoprotein triglyceride [Term] id: CHEBI:39053 name: nitrilotriacetate(1-) is_a: CHEBI:36299 ! tricarboxylic acid monoanion is_a: CHEBI:39054 ! NTA [Term] id: CHEBI:39054 name: NTA is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:38161 ! chelator [Term] id: CHEBI:39055 name: 2,2'-[(carboxymethyl)imino]diacetate is_a: CHEBI:39056 ! nitrilotriacetate(2-) [Term] id: CHEBI:39056 name: nitrilotriacetate(2-) is_a: CHEBI:36300 ! tricarboxylic acid dianion is_a: CHEBI:39054 ! NTA [Term] id: CHEBI:39057 name: 2,2',2''-ammoniotriacetate subset: chebi_ph7_3 is_a: CHEBI:39056 ! nitrilotriacetate(2-) [Term] id: CHEBI:39093 name: organophosphorus pesticide is_a: CHEBI:25710 ! organophosphorus compound relationship: has_role CHEBI:25944 ! pesticide [Term] id: CHEBI:39116 name: pyrethroid ester insecticide is_a: CHEBI:26413 ! pyrethroid insecticide [Term] id: CHEBI:39123 name: calcium cation is_a: CHEBI:33513 ! alkaline earth cation is_a: CHEBI:39124 ! calcium ion [Term] id: CHEBI:39124 name: calcium ion is_a: CHEBI:25213 ! metal cation is_a: CHEBI:35155 ! elemental calcium [Term] id: CHEBI:39127 name: magnesium cation is_a: CHEBI:33513 ! alkaline earth cation is_a: CHEBI:39128 ! magnesium ion [Term] id: CHEBI:39128 name: magnesium ion is_a: CHEBI:33973 ! elemental magnesium [Term] id: CHEBI:39141 name: Bronsted acid is_a: CHEBI:17891 ! donor is_a: CHEBI:37527 ! acid [Term] id: CHEBI:39142 name: Bronsted base is_a: CHEBI:15339 ! acceptor is_a: CHEBI:22695 ! base [Term] id: CHEBI:39143 name: Lewis acid is_a: CHEBI:15339 ! acceptor is_a: CHEBI:37527 ! acid [Term] id: CHEBI:39144 name: Lewis base is_a: CHEBI:17891 ! donor is_a: CHEBI:22695 ! base [Term] id: CHEBI:39146 name: trichostatin is_a: CHEBI:49319 ! carbocyclic antibiotic [Term] id: CHEBI:39150 name: 4-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:25798 ! oxopentanoates relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:39153 name: 5-oxopentanoic acid is_a: CHEBI:25799 ! oxopentanoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:39154 name: chlorocyclohexane is_a: CHEBI:39155 ! chlorocycloalkane [Term] id: CHEBI:39155 name: chlorocycloalkane is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:39157 name: trichostatic acid is_a: CHEBI:35983 ! 7-oxo monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:39158 name: (R)-trichostatic acid is_a: CHEBI:39157 ! trichostatic acid [Term] id: CHEBI:39159 name: (S)-trichostatic acid is_a: CHEBI:39157 ! trichostatic acid [Term] id: CHEBI:39161 name: 1,1,1-trichloro-2,2-diphenylethane subset: chebi_ph7_3 is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:39162 name: (R)-nicotine is_a: CHEBI:138000 ! 3-(1-methylpyrrolidin-2-yl)pyridine [Term] id: CHEBI:39166 name: tetramine is_a: CHEBI:88061 ! polyamine [Term] id: CHEBI:39172 name: monochloropyridine is_a: CHEBI:39173 ! chloropyridine [Term] id: CHEBI:39173 name: chloropyridine is_a: CHEBI:26421 ! pyridines is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:39174 name: 2-chloropyridine subset: chebi_ph7_3 is_a: CHEBI:39172 ! monochloropyridine [Term] id: CHEBI:3918 name: crocetin is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35311 ! carotenoic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:39192 name: dithiolanes is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:39201 name: phenazines is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:39203 name: dibenzopyran is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:39205 name: dibenzopyrrole is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:39206 name: dibenzopyridine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:39208 name: antibiotic insecticide is_a: CHEBI:24852 ! insecticide is_a: CHEBI:39215 ! antibiotic pesticide [Term] id: CHEBI:39215 name: antibiotic pesticide is_a: CHEBI:25944 ! pesticide is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:39226 name: chlorocarbon is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:39236 name: alpha-farnesene subset: chebi_ph7_3 is_a: CHEBI:39237 ! farnesene [Term] id: CHEBI:39237 name: farnesene is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:39241 name: beta-farnesene subset: chebi_ph7_3 is_a: CHEBI:39237 ! farnesene [Term] id: CHEBI:39246 name: nonadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:39250 name: isopentadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:39252 name: pyridophenoxazine is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38180 ! polycyclic heteroarene [Term] id: CHEBI:39258 name: diphenyl ether subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:39259 name: pyrethroid ester acaricide is_a: CHEBI:22153 ! acaricide [Term] id: CHEBI:39268 name: dibenzothiazepine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:39270 name: naphthofuran is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:39275 name: bromomethane subset: chebi_ph7_3 is_a: CHEBI:22926 ! bromohydrocarbon is_a: CHEBI:25253 ! methyl halides is_a: CHEBI:39278 ! bromomethanes relationship: has_role CHEBI:39277 ! fumigant insecticide relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:39276 name: fumigant is_a: CHEBI:25944 ! pesticide [Term] id: CHEBI:39277 name: fumigant insecticide is_a: CHEBI:24852 ! insecticide is_a: CHEBI:39276 ! fumigant [Term] id: CHEBI:39278 name: bromomethanes is_a: CHEBI:22929 ! bromoalkane is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:39279 name: halomethane is_a: CHEBI:24469 ! haloalkane is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:39281 name: fluoromethanes is_a: CHEBI:24067 ! fluoroalkane is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:39282 name: iodomethane subset: chebi_ph7_3 is_a: CHEBI:25253 ! methyl halides is_a: CHEBI:39284 ! iodomethanes relationship: has_role CHEBI:39277 ! fumigant insecticide [Term] id: CHEBI:39284 name: iodomethanes is_a: CHEBI:37757 ! iodoalkane is_a: CHEBI:39279 ! halomethane [Term] id: CHEBI:39304 name: coformycins is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:39305 ! imidazodiazepine relationship: has_role CHEBI:25605 ! nucleoside antibiotic [Term] id: CHEBI:39305 name: imidazodiazepine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:39306 name: pyrimidodiazepine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:39308 name: 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:39317 name: growth regulator is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:39352 name: dinitrophenol is_a: CHEBI:25562 ! nitrophenol [Term] id: CHEBI:39362 name: mononitrophenol is_a: CHEBI:25562 ! nitrophenol [Term] id: CHEBI:3941 name: cucurbitacin B subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16219 ! cucurbitacin is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:39412 name: bridged diphenyl acaricide is_a: CHEBI:22153 ! acaricide [Term] id: CHEBI:39417 name: branched-chain saturated fatty acid is_a: CHEBI:26607 ! saturated fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid [Term] id: CHEBI:39418 name: straight-chain saturated fatty acid is_a: CHEBI:26607 ! saturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:39430 name: dioxolane is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:39432 name: furochromene is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:39434 name: limonoid is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:39435 name: cycloheptafuran is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:39436 name: chromenol is_a: CHEBI:23232 ! chromenes [Term] id: CHEBI:39437 name: tocol is_a: CHEBI:23229 ! chromanol relationship: has_role CHEBI:22586 ! antioxidant [Term] id: CHEBI:39439 name: benzoquinone is_a: CHEBI:22729 ! benzoquinones [Term] id: CHEBI:39442 name: fluorescent probe is_a: CHEBI:50406 ! probe [Term] id: CHEBI:39446 name: pyrimidine ribonucleosides is_a: CHEBI:18254 ! ribonucleoside is_a: CHEBI:26440 ! pyrimidine nucleoside [Term] id: CHEBI:39447 name: pyrimidines is_a: CHEBI:38313 ! diazines [Term] id: CHEBI:39448 name: undecenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:39449 name: 2-undecenoic acid is_a: CHEBI:39448 ! undecenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:39450 name: trans-undec-2-enoic acid is_a: CHEBI:39449 ! 2-undecenoic acid [Term] id: CHEBI:39456 name: antiglaucoma drug is_a: CHEBI:66981 ! ophthalmology drug [Term] id: CHEBI:39457 name: pyrimidine ribonucleoside 5'-monophosphate is_a: CHEBI:26443 ! pyrimidine ribonucleoside monophosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:39474 name: polyazaalkane is_a: CHEBI:46686 ! azaalkane is_a: CHEBI:88061 ! polyamine [Term] id: CHEBI:39482 name: chloroolefin is_a: CHEBI:23115 ! chlorohydrocarbon [Term] id: CHEBI:39547 name: (R)-carnitinium is_a: CHEBI:3424 ! carnitinium [Term] id: CHEBI:39564 name: (1R,6R)-2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid is_a: CHEBI:11656 ! 2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid [Term] id: CHEBI:39567 name: 12-hydroxylauric acid is_a: CHEBI:194303 ! omega-hydroxy-medium-chain fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:39573 name: (13R)-HPODE is_a: CHEBI:91272 ! 13-HPODE [Term] id: CHEBI:3962 name: curcumin subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:51689 ! enone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:78802 ! diarylheptanoid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:35856 ! lipoxygenase inhibitor relationship: has_role CHEBI:37958 ! dye relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:48550 ! EC 1.1.1.21 (aldehyde reductase) inhibitor relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:49323 ! contraceptive drug relationship: has_role CHEBI:50390 ! EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:52214 ! ligand relationship: has_role CHEBI:53746 ! EC 1.1.1.205 (IMP dehydrogenase) inhibitor relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:64670 ! EC 1.8.1.9 (thioredoxin reductase) inhibitor relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76617 ! EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor relationship: has_role CHEBI:77182 ! food colouring relationship: has_role CHEBI:77484 ! EC 1.1.1.25 (shikimate dehydrogenase) inhibitor [Term] id: CHEBI:39737 name: D-sorbose 1-phosphate is_a: CHEBI:28173 ! sorbose 1-phosphate [Term] id: CHEBI:39745 name: dihydrogenphosphate is_a: CHEBI:35780 ! phosphate ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:3978 name: cyanin is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:39785 name: 1-pyrroline-2-carboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:39870 name: propylamine is_a: CHEBI:22331 ! alkylamines [Term] id: CHEBI:3992 name: cyclic ketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:39949 name: triphosphoric acid is_a: CHEBI:33457 ! phosphorus oxoacid is_a: CHEBI:37786 ! acyclic phosphorus acid anhydride [Term] id: CHEBI:40 name: (+)-pinoresinol subset: chebi_ph7_3 is_a: CHEBI:8225 ! pinoresinol relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:40009 name: D-cycloserine is_a: CHEBI:23503 ! 4-amino-1,2-oxazolidin-3-one is_a: CHEBI:25558 ! organonitrogen heterocyclic antibiotic is_a: CHEBI:25807 ! organooxygen heterocyclic antibiotic relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:64571 ! NMDA receptor agonist [Term] id: CHEBI:40036 name: amitrole subset: chebi_ph7_3 is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:35727 ! triazoles relationship: has_role CHEBI:138208 ! carotenoid biosynthesis inhibitor relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:75380 ! EC 1.11.1.6 (catalase) inhibitor [Term] id: CHEBI:40070 name: 4-hydroxycoumarin is_a: CHEBI:37912 ! hydroxycoumarin [Term] id: CHEBI:40096 name: adenosine 5'-(hexahydrogen pentaphosphate) is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:37102 ! nucleoside pentaphosphate [Term] id: CHEBI:40196 name: N(6)-methyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:40235 name: 9H-purine-2,6-diamine subset: chebi_ph7_3 is_a: CHEBI:38001 ! 2,6-diaminopurines is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:4027 name: cyclophosphamide subset: chebi_ph7_3 is_a: CHEBI:35467 ! phosphorodiamide is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37598 ! nitrogen mustard relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:35842 ! antirheumatic drug relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:40303 name: lovastatin subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:87632 ! statin (naturally occurring) relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:4031 name: cyclosporin A subset: chebi_ph7_3 is_a: CHEBI:24613 ! homodetic cyclic peptide relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:35842 ! antirheumatic drug relationship: has_role CHEBI:37153 ! EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor relationship: has_role CHEBI:49167 ! anti-asthmatic drug relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:40356 name: N-acetyl-alpha-D-galactosamine subset: chebi_ph7_3 is_a: CHEBI:28037 ! N-acetyl-D-galactosamine relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:40407 name: 2-octaprenylphenol subset: chebi_ph7_3 is_a: CHEBI:1269 ! 2-polyprenylphenol relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:40410 name: N-acetylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:21575 ! N-acetyl-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:40460 name: 2'-O-methyladenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:4047 name: L-cysteinylglycine is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:40519 name: adamantane subset: chebi_ph7_3 is_a: CHEBI:35713 ! polycyclic alkane is_a: CHEBI:51339 ! adamantanes [Term] id: CHEBI:405237 name: L-canavanine zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:40538 name: benzylamine is_a: CHEBI:18000 ! aralkylamine is_a: CHEBI:32877 ! primary amine relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77118 ! EC 3.5.5.1 (nitrilase) inhibitor [Term] id: CHEBI:4056 name: cytochrome is_a: CHEBI:35137 ! hemoprotein [Term] id: CHEBI:40611 name: adamantanone subset: chebi_ph7_3 is_a: CHEBI:22235 ! adamantanones [Term] id: CHEBI:40656 name: beta-D-allose subset: chebi_ph7_3 is_a: CHEBI:4093 ! D-allopyranose [Term] id: CHEBI:40666 name: 1,6-anhydro-N-acetyl-beta-muramic acid is_a: CHEBI:63379 ! anhydrohexose derivative [Term] id: CHEBI:40673 name: L-2-amino-3-oxobutanoic acid is_a: CHEBI:17844 ! 2-amino-3-oxobutanoic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:40721 name: adenosine 5'-monophosphate(1+) is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:40729 name: N-acetyl-beta-D-muramic acid is_a: CHEBI:21615 ! N-acetyl-D-muramic acid [Term] id: CHEBI:4075 name: (R)-(1-aminoethyl)phosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:40751 name: (S)-adrenaline is_a: CHEBI:194548 ! 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol [Term] id: CHEBI:40753 name: 9-anthrol subset: chebi_ph7_3 is_a: CHEBI:37088 ! anthrol [Term] id: CHEBI:4077 name: (4R,5S,6R)-2,4,5,6-tetrahydroxycyclohex-2-en-1-one subset: chebi_ph7_3 is_a: CHEBI:33823 ! enol is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51689 ! enone [Term] id: CHEBI:40799 name: androsta-1,4-diene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:20156 ! 3-oxo-Delta(1) steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:40813 name: 4-methoxybenzoic acid is_a: CHEBI:25238 ! methoxybenzoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:40822 name: aldehydo-D-allose subset: chebi_ph7_3 is_a: CHEBI:17393 ! D-allose is_a: CHEBI:37748 ! aldehydo-allose [Term] id: CHEBI:4083 name: D-4-hydroxy-2-oxoglutaric acid is_a: CHEBI:30923 ! 4-hydroxy-2-oxoglutaric acid [Term] id: CHEBI:40886 name: beta-L-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:17535 ! L-arabinopyranose [Term] id: CHEBI:40910 name: azide anion subset: chebi_ph7_3 is_a: CHEBI:36828 ! pseudohalide anion relationship: has_role CHEBI:25355 ! mitochondrial respiratory-chain inhibitor [Term] id: CHEBI:4093 name: D-allopyranose subset: chebi_ph7_3 is_a: CHEBI:17393 ! D-allose is_a: CHEBI:37742 ! allopyranose relationship: has_role CHEBI:22586 ! antioxidant [Term] id: CHEBI:40968 name: astaxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77182 ! food colouring [Term] id: CHEBI:40992 name: N-acetyl-L-alanine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:41117 name: N-benzylformamide subset: chebi_ph7_3 is_a: CHEBI:24079 ! formamides [Term] id: CHEBI:41131 name: crotonic acid is_a: CHEBI:17217 ! 2-butenoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:41132 name: tetrahydroxoborate(1-) subset: chebi_ph7_3 is_a: CHEBI:22909 ! borate ion [Term] id: CHEBI:41139 name: N,N,N-trimethylglycinium is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:4116 name: D-erythrulose 4-phosphate is_a: CHEBI:24980 ! ketotetrose phosphate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:41183 name: D-erythro-biopterin subset: chebi_ph7_3 is_a: CHEBI:15373 ! biopterin [Term] id: CHEBI:41189 name: butane-1,4-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:52684 ! butanediol relationship: has_role CHEBI:48356 ! protic solvent relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:41218 name: mercaptoethanol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:47908 ! alkanethiol relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:41237 name: benzyl benzoate subset: chebi_ph7_3 is_a: CHEBI:36054 ! benzoate ester is_a: CHEBI:90628 ! benzyl ester relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:73333 ! scabicide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:41241 name: (R)-2-benzylsuccinic acid is_a: CHEBI:16054 ! 2-benzylsuccinic acid relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:412516 name: 5-hydroxymethylfurfural subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:24129 ! furans is_a: CHEBI:33855 ! arenecarbaldehyde relationship: has_role CHEBI:47867 ! indicator relationship: has_role CHEBI:77523 ! Maillard reaction product [Term] id: CHEBI:41253 name: tetradecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:4126 name: D-fructofuranuronic acid is_a: CHEBI:20937 ! D-fructuronic acid [Term] id: CHEBI:41275 name: 1H-benzimidazole subset: chebi_ph7_3 is_a: CHEBI:36622 ! benzimidazole is_a: CHEBI:38180 ! polycyclic heteroarene [Term] id: CHEBI:41308 name: benzophenone subset: chebi_ph7_3 is_a: CHEBI:22726 ! benzophenones relationship: has_role CHEBI:47868 ! photosensitizing agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:41321 name: cholesterol sulfate is_a: CHEBI:16158 ! steroid sulfate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:4139 name: D-galactopyranose subset: chebi_ph7_3 is_a: CHEBI:12936 ! D-galactose is_a: CHEBI:37621 ! galactopyranose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:41402 name: carboxymethyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:4141 name: D-galactopyranose 6-phosphate is_a: CHEBI:12937 ! D-galactose 6-phosphate is_a: CHEBI:61667 ! D-hexopyranose 6-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:41425 name: (7R)-7-(4-carboxybutanamido)cephalosporanic acid is_a: CHEBI:23066 ! cephalosporin [Term] id: CHEBI:41450 name: gamma-carboxy-L-glutamic acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:41482 name: (R)-carnitinyl-CoA betaine is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:41487 name: oxidized Oplophorus luciferin subset: chebi_ph7_3 is_a: CHEBI:38314 ! pyrazines relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:41509 name: cholesteryl linoleate subset: chebi_ph7_3 is_a: CHEBI:183799 ! CE(18:2) is_a: CHEBI:46903 ! cholesteryl octadeca-9,12-dienoate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:4153 name: D-galactopyranuronic acid is_a: CHEBI:18024 ! D-galacturonic acid [Term] id: CHEBI:41550 name: fluoroform subset: chebi_ph7_3 is_a: CHEBI:39281 ! fluoromethanes relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:41582 name: D-pipecolic acid is_a: CHEBI:17964 ! pipecolic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:41595 name: (+)-germacrene A subset: chebi_ph7_3 is_a: CHEBI:36517 ! germacrene A [Term] id: CHEBI:41609 name: carbonate is_a: CHEBI:35604 ! carbon oxoanion [Term] id: CHEBI:41625 name: chromopyrrolic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:59197 ! pyrroledicarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:41630 name: S-oxy-L-cysteine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:41633 name: 24(S),25-epoxycholesterol subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:86029 ! liver X receptor agonist [Term] id: CHEBI:4167 name: D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:17634 ! D-glucose is_a: CHEBI:37661 ! glucopyranose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:41674 name: cyclohexane-1,2-dione subset: chebi_ph7_3 is_a: CHEBI:23478 ! cyclohexanedione [Term] id: CHEBI:41688 name: crystal violet is_a: CHEBI:36094 ! organic chloride salt relationship: has_part CHEBI:77181 ! crystal violet cation relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:77178 ! histological dye [Term] id: CHEBI:4170 name: D-glucopyranose 6-phosphate is_a: CHEBI:14314 ! D-glucose 6-phosphate is_a: CHEBI:61667 ! D-hexopyranose 6-phosphate [Term] id: CHEBI:41710 name: S-hydroxy-L-cysteine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:41721 name: L-cysteine-S-dioxide is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:4177 name: D-glucosylsphingosine is_a: CHEBI:35436 ! D-glucoside [Term] id: CHEBI:4178 name: D-glucuronic acid is_a: CHEBI:24298 ! glucuronic acid [Term] id: CHEBI:41808 name: decane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane [Term] id: CHEBI:41837 name: (4S,5S)-1,2-dithiane-4,5-diol subset: chebi_ph7_3 is_a: CHEBI:16912 ! trans-1,2-dithiane-4,5-diol [Term] id: CHEBI:41847 name: 1,2-dioctadecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:86987 ! diacylglycerol 36:0 [Term] id: CHEBI:41865 name: sebacic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:41879 name: dexamethasone subset: chebi_ph7_3 is_a: CHEBI:24261 ! glucocorticoid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:50830 ! fluorinated steroid is_a: CHEBI:77166 ! 3-oxo-Delta(1),Delta(4)-steroid relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:37962 ! adrenergic agent relationship: has_role CHEBI:50919 ! antiemetic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:4188 name: D-glycero-D-manno-heptose 1,7-bisphosphate is_a: CHEBI:35157 ! aldoheptose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:41893 name: 4-deoxy-Delta(4)-beta-D-GlcpA is_a: CHEBI:27252 ! uronic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:41917 name: 4-phospho-L-threonic acid is_a: CHEBI:49064 ! 4-phosphothreonic acid [Term] id: CHEBI:41929 name: 2-deoxy-5-O-phosphono-beta-L-ribofuranosylcytosine is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:4194 name: D-hexose subset: chebi_ph7_3 is_a: CHEBI:18133 ! hexose [Term] id: CHEBI:41941 name: (3,4-dihydroxyphenyl)acetic acid is_a: CHEBI:33566 ! catechols is_a: CHEBI:61409 ! dihydroxyphenylacetic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:41945 name: 9-(2-deoxy-5-O-phosphono-beta-L-ribofuranosyl)guanine is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:4195 name: D-hexose 6-phosphate is_a: CHEBI:15965 ! D-hexose phosphate is_a: CHEBI:47877 ! hexose 6-phosphate [Term] id: CHEBI:41963 name: (-)-taxifolin subset: chebi_ph7_3 is_a: CHEBI:38747 ! taxifolin [Term] id: CHEBI:41977 name: daunorubicin is_a: CHEBI:22507 ! aminoglycoside antibiotic is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:41983 name: 4'-epidoxorubicinium subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:42017 name: 2,4-dinitrophenol is_a: CHEBI:39352 ! dinitrophenol relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:73267 ! oxidative phosphorylation inhibitor relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:42027 name: 1,2-di-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167148 ! 1-linoleoyl-2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:84815 ! 1,2-di-octadecadienoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:4208 name: D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:16024 ! D-mannose is_a: CHEBI:17608 ! D-aldohexose is_a: CHEBI:37683 ! mannopyranose relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:42085 name: (7R,8S)-7,8-diaminononanoic acid is_a: CHEBI:2247 ! 7,8-diaminononanoic acid [Term] id: CHEBI:42088 name: alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:62263 ! alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-D-GlcpNAc [Term] id: CHEBI:42090 name: L-threitol subset: chebi_ph7_3 is_a: CHEBI:26981 ! threitol relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:42101 name: D-norleucine is_a: CHEBI:36405 ! 2-aminohexanoic acid [Term] id: CHEBI:42111 name: (R)-lactic acid is_a: CHEBI:78320 ! 2-hydroxypropanoic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:42112 name: 1-(2-deoxy-5-O-phosphono-beta-L-ribofuranosyl)thymine is_a: CHEBI:36995 ! pyrimidine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:42115 name: 3-deoxy-alpha-D-manno-2-octulosonic acid 8-phosphate is_a: CHEBI:24962 ! ketoaldonic acid phosphate is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:42147 name: (4R,5R)-1,2-dithiane-4,5-diol subset: chebi_ph7_3 is_a: CHEBI:16912 ! trans-1,2-dithiane-4,5-diol [Term] id: CHEBI:42156 name: 17-epiestriol subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:63951 ! estrogen receptor agonist relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:42164 name: 3-ammonio-L-alanine is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:42191 name: EDTA(4-) is_a: CHEBI:35754 ! tetracarboxylic acid anion [Term] id: CHEBI:422 name: (S)-lactic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:78320 ! 2-hydroxypropanoic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:42202 name: daidzein 7-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:140301 ! 7-hydroxyisoflavones 7-O-beta-D-glucoside is_a: CHEBI:38755 ! hydroxyisoflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:4222 name: D-pantetheine 4'-phosphate is_a: CHEBI:16858 ! pantetheine 4'-phosphate relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:42223 name: emodin is_a: CHEBI:37488 ! trihydroxyanthraquinone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38637 ! tyrosine kinase inhibitor relationship: has_role CHEBI:50503 ! laxative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:42255 name: (-)-epigallocatechin subset: chebi_ph7_3 is_a: CHEBI:23053 ! catechin is_a: CHEBI:71224 ! flavan-3,3',4',5,5',7-hexol relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:42266 name: ethane subset: chebi_ph7_3 is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:42280 name: (4R,5S)-dethiobiotin is_a: CHEBI:16691 ! dethiobiotin [Term] id: CHEBI:42355 name: erythromycin A is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:48923 ! erythromycin [Term] id: CHEBI:42362 name: (6E,10E)-2,6,10-trimethyldodeca-2,6,10-triene subset: chebi_ph7_3 is_a: CHEBI:36534 ! 2,6,10-trimethyldodeca-2,6,10-triene [Term] id: CHEBI:42394 name: tricosanoic acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:42438 name: 2-methoxy-4-vinylphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:42465 name: ethanesulfonic acid is_a: CHEBI:47901 ! alkanesulfonic acid [Term] id: CHEBI:42471 name: forskolin subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:27136 ! triol is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:64946 ! anti-HIV agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78547 ! protein kinase A agonist relationship: has_role CHEBI:78548 ! adenylate cyclase agonist [Term] id: CHEBI:42485 name: formyl group subset: chebi_ph7_3 is_a: CHEBI:27207 ! univalent carboacyl group [Term] id: CHEBI:4249 name: D-tagatopyranose subset: chebi_ph7_3 is_a: CHEBI:16443 ! D-tagatose [Term] id: CHEBI:4250 name: D-tagatofuranose 1,6-bisphosphate is_a: CHEBI:16743 ! D-tagatose 1,6-bisphosphate [Term] id: CHEBI:42504 name: pentadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:4251 name: D-tagatofuranose 6-phosphate is_a: CHEBI:17837 ! D-tagatose 6-phosphate [Term] id: CHEBI:42534 name: epitestosterone subset: chebi_ph7_3 is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:35497 ! androgen antagonist relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:42539 name: (R)-3-hydroxytetradecanoic acid is_a: CHEBI:85148 ! 3-hydroxytetradecanoic acid is_a: CHEBI:85678 ! (3R)-3-hydroxy fatty acid [Term] id: CHEBI:42548 name: alpha-L-fucose subset: chebi_ph7_3 is_a: CHEBI:2181 ! L-fucopyranose relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:42564 name: alpha-D-fucose subset: chebi_ph7_3 is_a: CHEBI:2179 ! D-fucopyranose relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:42589 name: beta-L-fucose subset: chebi_ph7_3 is_a: CHEBI:2181 ! L-fucopyranose [Term] id: CHEBI:425902 name: propiophenone subset: chebi_ph7_3 is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:48318 ! fragrance [Term] id: CHEBI:42626 name: glycyl-AMP zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:42630 name: propylbenzene subset: chebi_ph7_3 is_a: CHEBI:38976 ! alkylbenzene [Term] id: CHEBI:42646 name: flaviolin is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:42660 name: GDP-beta-L-galactose is_a: CHEBI:18038 ! GDP-L-galactose [Term] id: CHEBI:42677 name: (2R)-2-hydroxypropylammonium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:42717 name: alpha-D-glucuronic acid is_a: CHEBI:47952 ! D-glucopyranuronic acid [Term] id: CHEBI:42724 name: (R)-amphetamine is_a: CHEBI:132233 ! 1-phenylpropan-2-amine [Term] id: CHEBI:42758 name: aldehydo-D-glucose subset: chebi_ph7_3 is_a: CHEBI:17634 ! D-glucose is_a: CHEBI:37663 ! aldehydo-glucose [Term] id: CHEBI:4280 name: (2R,4S)-2,4-diaminopentanoic acid is_a: CHEBI:904 ! 2,4-diaminopentanoic acid [Term] id: CHEBI:42819 name: 5-dehydro-4-deoxy-D-glucarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:42820 name: guanidine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:35359 ! carboxamidine is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:42896 name: 1-thio-beta-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:29256 ! thiol is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:73754 ! thiosugar [Term] id: CHEBI:42905 name: alpha-L-galactose subset: chebi_ph7_3 is_a: CHEBI:37619 ! L-galactopyranose [Term] id: CHEBI:42939 name: cyclohexylammonium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:42977 name: 25-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:36864 ! 25-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:42989 name: 7beta-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:43029 name: L-erythro-7,8-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:64277 ! 7,8-dihydrobiopterin [Term] id: CHEBI:43034 name: 7,8-didemethyl-8-hydroxy-5-deazariboflavin is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:43035 name: (R)-hydratropic acid is_a: CHEBI:48526 ! hydratropic acid [Term] id: CHEBI:43056 name: S-nitrosoglutathione(2-) is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:43065 name: (S)-3-phenyllactic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:25998 ! 3-phenyllactic acid [Term] id: CHEBI:43074 name: (3S)-3-hydroxy-3-methylglutaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:43088 name: N(5)-[(hydroxyamino)(imino)methyl]-L-ornithine is_a: CHEBI:28538 ! N(omega)-hydroxy-L-arginine is_a: CHEBI:47827 ! N(5)-[(hydroxyamino)(imino)methyl]ornithine [Term] id: CHEBI:43098 name: heptane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:43120 name: (6R)-L-erythro-6,7-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:20680 ! 6,7-dihydrobiopterin [Term] id: CHEBI:43129 name: (+)-6a-hydroxymaackiain subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:43176 name: hydroxy group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:43186 name: 5-hydroxy-D-tryptophan is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:28171 ! 5-hydroxytryptophan is_a: CHEBI:47997 ! D-tryptophan derivative [Term] id: CHEBI:43197 name: (R)-3-hydroxylauric acid is_a: CHEBI:36206 ! 3-hydroxylauric acid is_a: CHEBI:85678 ! (3R)-3-hydroxy fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:43254 name: (4S)-4-hydroxy-3,4-dihydropyrimidin-2(1H)-one is_a: CHEBI:38337 ! pyrimidone [Term] id: CHEBI:43291 name: L-erythro-isocitric acid is_a: CHEBI:30887 ! isocitric acid [Term] id: CHEBI:43419 name: isoursodeoxycholic acid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:43433 name: L-alloisoleucine is_a: CHEBI:22359 ! alloisoleucine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:43445 name: (+)-aristolochene subset: chebi_ph7_3 is_a: CHEBI:36529 ! aristolochene [Term] id: CHEBI:43451 name: hydrogen iodide is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18140 ! hydrogen halide is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:43468 name: (2R,3S)-3-isopropylmalic acid is_a: CHEBI:35114 ! 3-isopropylmalic acid [Term] id: CHEBI:43474 name: hydrogenphosphate subset: chebi_ph7_3 is_a: CHEBI:35780 ! phosphate ion is_a: CHEBI:79388 ! divalent inorganic anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:43572 name: kojic acid subset: chebi_ph7_3 is_a: CHEBI:131906 ! 4-pyranones is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33823 ! enol relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:85046 ! skin lightening agent relationship: has_role CHEBI:85049 ! EC 1.10.3.1 (catechol oxidase) inhibitor relationship: has_role CHEBI:85050 ! EC 1.10.3.2 (laccase) inhibitor relationship: has_role CHEBI:85051 ! EC 1.13.11.24 (quercetin 2,3-dioxygenase) inhibitor relationship: has_role CHEBI:85052 ! EC 1.4.3.3 (D-amino-acid oxidase) inhibitor [Term] id: CHEBI:43577 name: 3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid is_a: CHEBI:11791 ! 3-deoxy-D-manno-octulosonic acid [Term] id: CHEBI:43615 name: 2H-imidazol-4-ylacetic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:43619 name: icosane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:43703 name: beta-L-fructofuranose subset: chebi_ph7_3 is_a: CHEBI:37725 ! L-fructofuranose [Term] id: CHEBI:43711 name: (R)-dihydrolipoamide subset: chebi_ph7_3 is_a: CHEBI:17694 ! dihydrolipoamide [Term] id: CHEBI:4372 name: (6S)-dehydrovomifoliol subset: chebi_ph7_3 is_a: CHEBI:18429 ! dehydrovomifoliol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:43722 name: isomyristic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid [Term] id: CHEBI:43732 name: thiazole subset: chebi_ph7_3 is_a: CHEBI:35555 ! mancude organic heteromonocyclic parent is_a: CHEBI:38179 ! monocyclic heteroarene is_a: CHEBI:38418 ! 1,3-thiazoles [Term] id: CHEBI:437678 name: (S)-columbianetin subset: chebi_ph7_3 is_a: CHEBI:59948 ! columbianetin [Term] id: CHEBI:43786 name: D-glycero-alpha-D-manno-heptose 7-phosphate is_a: CHEBI:28723 ! D-glycero-D-manno-heptose 7-phosphate [Term] id: CHEBI:43796 name: (S)-lipoic acid is_a: CHEBI:16494 ! lipoic acid is_a: CHEBI:39192 ! dithiolanes is_a: CHEBI:48847 ! heterocyclic fatty acid is_a: CHEBI:59643 ! thia fatty acid [Term] id: CHEBI:43797 name: L-propargylglycine is_a: CHEBI:73477 ! terminal acetylenic compound is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:137566 ! EC 2.5.1.48 (cystathionine gamma-synthase) inhibitor relationship: has_role CHEBI:144097 ! EC 1.4.3.2 (L-amino-acid oxidase) inhibitor relationship: has_role CHEBI:144099 ! EC 2.6.1.2 (alanine transaminase) inhibitor [Term] id: CHEBI:43799 name: butan-1-amine is_a: CHEBI:17062 ! primary aliphatic amine [Term] id: CHEBI:43858 name: L-vinylglycine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:136984 ! EC 4.4.1.14 (1-aminocyclopropane-1-carboxylate synthase) inhibitor [Term] id: CHEBI:43896 name: alpha-D-mannose 6-phosphate is_a: CHEBI:48066 ! D-mannopyranose 6-phosphate relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:43903 name: N(pros)-methyl-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:43966 name: melagatran is_a: CHEBI:35359 ! carboxamidine is_a: CHEBI:35735 ! dicarboxylic acid monoamide is_a: CHEBI:38777 ! azetidines is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:64926 ! serine protease inhibitor relationship: has_role CHEBI:65232 ! EC 3.4.21.5 (thrombin) inhibitor [Term] id: CHEBI:43967 name: N(2),N(2)-dimethylguanosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:439819 name: L-alpha-phenylglycine is_a: CHEBI:55484 ! alpha-phenylglycine [Term] id: CHEBI:43986 name: N(6),N(6)-dimethyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:43991 name: malonamic acid is_a: CHEBI:22823 ! beta-alanine derivative [Term] id: CHEBI:43997 name: N(6),N(6)-dimethyl-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:44027 name: menaquinone-8 subset: chebi_ph7_3 is_a: CHEBI:16374 ! menaquinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:44074 name: molybdopterin is_a: CHEBI:35203 ! molybdopterins [Term] id: CHEBI:44075 name: methyl L-leucinate is_a: CHEBI:25018 ! L-leucine derivative is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:46874 ! alpha-amino acid ester [Term] id: CHEBI:44089 name: (2S)-2-methyltetradecanoyl-CoA is_a: CHEBI:15451 ! (2S)-2-methylacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:44111 name: 3-mercaptopropanoic acid is_a: CHEBI:47871 ! mercaptopropanoic acid relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:44120 name: L-methionine (S)-S-oxide residue subset: chebi_ph7_3 is_a: CHEBI:15989 ! L-methionine S-oxide residue [Term] id: CHEBI:44147 name: menaquinone-9 subset: chebi_ph7_3 is_a: CHEBI:16374 ! menaquinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:44185 name: methotrexate is_a: CHEBI:26373 ! pteridines is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:35842 ! antirheumatic drug relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:50683 ! EC 1.5.1.3 (dihydrofolate reductase) inhibitor relationship: has_role CHEBI:50691 ! abortifacient relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor [Term] id: CHEBI:44215 name: NAD zwitterion is_a: CHEBI:13389 ! NAD relationship: has_role CHEBI:176497 ! geroprotector [Term] id: CHEBI:44230 name: 6-(alpha-D-glucosaminyl)-1D-myo-inositol is_a: CHEBI:35373 ! D-glucosaminide is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:44236 name: (S)-NADHX is_a: CHEBI:26916 ! tetrahydronicotinamide adenine dinucleotide is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:44245 name: menaquinone-7 subset: chebi_ph7_3 is_a: CHEBI:16374 ! menaquinone relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:44247 name: (15Z)-tetracosenoic acid is_a: CHEBI:36032 ! tetracosenoic acid [Term] id: CHEBI:44278 name: N-acetyl-alpha-D-glucosamine subset: chebi_ph7_3 is_a: CHEBI:506227 ! N-acetyl-D-glucosamine [Term] id: CHEBI:4429 name: deoxypodophyllotoxin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:50307 ! furonaphthodioxole is_a: CHEBI:51683 ! methoxybenzenes relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:44303 name: L-m-tyrosine is_a: CHEBI:24734 ! hydroxyphenylalanine is_a: CHEBI:33853 ! phenols is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84144 ! L-phenylalanine derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:4431 name: deoxyribonucleotide is_a: CHEBI:23634 ! deoxyaldopentose phosphate is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:44312 name: beta-muramic acid is_a: CHEBI:7027 ! 2-amino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranose [Term] id: CHEBI:44313 name: N-acetyl-alpha-D-galactosamine 1-phosphate is_a: CHEBI:55404 ! N-acetyl-D-galactosamine 1-phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:44337 name: N-acetyl-L-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:44343 name: (1R,2S)-1,2-dihydronaphthalene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:15561 ! cis-1,2-dihydronaphthalene-1,2-diol [Term] id: CHEBI:44348 name: N-ethylsuccinimide subset: chebi_ph7_3 is_a: CHEBI:35356 ! dicarboximide is_a: CHEBI:38275 ! pyrrolidinone [Term] id: CHEBI:443725 name: fosmidomycin is_a: CHEBI:24650 ! hydroxamic acid is_a: CHEBI:26069 ! phosphonic acids relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77654 ! EC 1.1.1.267 (1-deoxy-D-xylulose-5-phosphate reductoisomerase) inhibitor [Term] id: CHEBI:4439 name: dermatan is_a: CHEBI:37395 ! mucopolysaccharide [Term] id: CHEBI:44395 name: N-acetyl-beta-D-galactosamine 6-sulfate is_a: CHEBI:24155 ! galactosamine sulfate [Term] id: CHEBI:44400 name: 2-iminiopropionate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:44409 name: NADP zwitterion is_a: CHEBI:25523 ! NADP relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:44423 name: hydroxyurea subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor relationship: has_role CHEBI:64911 ! antimitotic relationship: has_role CHEBI:74213 ! EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor [Term] id: CHEBI:44485 name: N-ethylmaleimide subset: chebi_ph7_3 is_a: CHEBI:55417 ! maleimides relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:77115 ! EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor relationship: has_role CHEBI:78366 ! EC 2.7.1.1 (hexokinase) inhibitor relationship: has_role CHEBI:78377 ! EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor [Term] id: CHEBI:44510 name: (S)-2-hydroxy-4-methylpentanoic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:59783 ! 2-hydroxy-4-methylvaleric acid [Term] id: CHEBI:44526 name: (10E,12Z)-octadecadienoic acid is_a: CHEBI:36331 ! octadeca-10,12-dienoic acid [Term] id: CHEBI:44549 name: 4-amino-5-aminomethyl-2-methylpyrimidine is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:44557 name: nitrilotriacetic acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:39054 ! NTA relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50909 ! nephrotoxic agent [Term] id: CHEBI:44576 name: 2'-hydroxybiphenyl-2-sulfinic acid is_a: CHEBI:24681 ! hydroxybiphenyls is_a: CHEBI:37783 ! organosulfinic acid [Term] id: CHEBI:44638 name: 2'-O-methylguanosine 5'-monophosphate is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:44639 name: tert-butylamine is_a: CHEBI:17062 ! primary aliphatic amine [Term] id: CHEBI:44642 name: 2'-O-methyluridine 5'-monophosphate is_a: CHEBI:27232 ! uridine 5'-phosphate [Term] id: CHEBI:44666 name: 2'-O-methylcytidine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:44667 name: L-ornithinium(2+) is_a: CHEBI:46913 ! ornithinium(2+) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:44678 name: alpha-D-glucosamine is_a: CHEBI:47977 ! 2-amino-2-deoxy-D-glucopyranose [Term] id: CHEBI:44680 name: 3-oxooctanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid [Term] id: CHEBI:4469 name: (S)-amphetamine is_a: CHEBI:132233 ! 1-phenylpropan-2-amine relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35640 ! adrenergic uptake inhibitor relationship: has_role CHEBI:37962 ! adrenergic agent relationship: has_role CHEBI:48560 ! dopaminergic agent relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:51039 ! dopamine uptake inhibitor [Term] id: CHEBI:4470 name: dextromethorphan is_a: CHEBI:146178 ! 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene relationship: has_role CHEBI:146270 ! oneirogen relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:51177 ! antitussive relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:44712 name: (S)-oxalosuccinic acid is_a: CHEBI:7815 ! oxalosuccinic acid [Term] id: CHEBI:44715 name: (R)-octopamine is_a: CHEBI:17134 ! octopamine [Term] id: CHEBI:44747 name: homogentisic acid is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:61409 ! dihydroxyphenylacetic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:44785 name: peroxide is_a: CHEBI:33263 ! diatomic oxygen [Term] id: CHEBI:44788 name: 2-succinylbenzoic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:44800 name: (2R,4S)-2-methyltetrahydrofuran-2,3,3,4-tetrol subset: chebi_ph7_3 is_a: CHEBI:33573 ! tetrol is_a: CHEBI:47041 ! tetrahydroxytetrahydrofuran is_a: CHEBI:59779 ! cyclic ketal is_a: CHEBI:63734 ! ketone hydrate relationship: has_role CHEBI:71338 ! autoinducer [Term] id: CHEBI:44808 name: (S)-octopamine is_a: CHEBI:17134 ! octopamine [Term] id: CHEBI:44811 name: 2-O-acetyl-1-O-hexadecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36707 ! 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:35530 ! beta-adrenergic antagonist relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:50141 ! bronchoconstrictor agent relationship: has_role CHEBI:50248 ! hematologic agent [Term] id: CHEBI:44813 name: N,N-dimethyl-L-prolinium is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:44841 name: 2-amino-6-(hydroxymethyl)-7,8-dihydropteridin-4-one subset: chebi_ph7_3 is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:44884 name: pentan-1-ol subset: chebi_ph7_3 is_a: CHEBI:143597 ! pentanol is_a: CHEBI:157770 ! short-chain primary fatty alcohol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:44897 name: phosphoenolpyruvic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:44898 name: pheophytin a is_a: CHEBI:8108 ! pheophytin [Term] id: CHEBI:44951 name: dioxidophosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:44962 name: D-alpha-phenylglycine is_a: CHEBI:55484 ! alpha-phenylglycine [Term] id: CHEBI:44976 name: phosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:33457 ! phosphorus oxoacid relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:44992 name: 2-aminopteridin-4(3H)-one subset: chebi_ph7_3 is_a: CHEBI:26374 ! pterin [Term] id: CHEBI:45013 name: 2-phospho-L-lactic acid is_a: CHEBI:340863 ! 2-phospholactic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:45021 name: palmitoyl group subset: chebi_ph7_3 is_a: CHEBI:24027 ! fatty-acyl group [Term] id: CHEBI:45049 name: 2-amino-9-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-9H-purin-6-ol is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:45064 name: phosphite(3-) is_a: CHEBI:26045 ! phosphite ion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:45075 name: 7-cyano-7-deazaguanine subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:38670 ! pyrrolopyrimidine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:45126 name: 7-aminomethyl-7-deazaguanine is_a: CHEBI:38670 ! pyrrolopyrimidine [Term] id: CHEBI:45129 name: methylphosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:45133 name: pivalic acid is_a: CHEBI:26666 ! short-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:45212 name: diphosphate(2-) is_a: CHEBI:35782 ! diphosphate ion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:45230 name: (R)-dihydrolipoic acid is_a: CHEBI:18047 ! dihydrolipoic acid [Term] id: CHEBI:45240 name: 1,2-di-O-myristoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine is_a: CHEBI:65294 ! phosphatidylcholine 28:0 is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:45257 name: ribostamycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:36047 ! antibacterial drug [Term] id: CHEBI:45285 name: pyrazinecarboxamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:38314 ! pyrazines is_a: CHEBI:83628 ! N-acylammonia relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:50266 ! prodrug [Term] id: CHEBI:45296 name: hexadecane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45373 name: sulfanilamide subset: chebi_ph7_3 is_a: CHEBI:35358 ! sulfonamide is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:87228 ! sulfonamide antibiotic relationship: has_role CHEBI:23018 ! EC 4.2.1.1 (carbonic anhydrase) inhibitor relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:45389 name: (R)-styrene oxide subset: chebi_ph7_3 is_a: CHEBI:17907 ! styrene oxide [Term] id: CHEBI:45394 name: TMP is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:45410 name: (S)-2-hydroxypropylphosphonic acid is_a: CHEBI:1171 ! 2-hydroxypropylphosphonic acid [Term] id: CHEBI:45441 name: N-acetyl-L-serine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:22194 ! acetyl-L-serine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:45479 name: 13-cis-retinol subset: chebi_ph7_3 is_a: CHEBI:50211 ! retinol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:45487 name: 13-cis-retinal subset: chebi_ph7_3 is_a: CHEBI:15035 ! retinal relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:45506 name: alpha-D-ribose subset: chebi_ph7_3 is_a: CHEBI:47013 ! D-ribofuranose [Term] id: CHEBI:45522 name: O-phospho-L-serine residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:45525 name: (R)-2-methylbutyric acid is_a: CHEBI:37070 ! 2-methylbutyric acid [Term] id: CHEBI:4553 name: dihydroanhydropodorhizol subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25036 ! lignan is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:51683 ! methoxybenzenes relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45557 name: sec-butyl group subset: chebi_ph7_3 is_a: CHEBI:22323 ! alkyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:45564 name: 5-hydroxypentanoic acid is_a: CHEBI:194306 ! omega-hydroxy-short-chain fatty acid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:45571 name: heptanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45599 name: dodecyl hydrogen sulfate is_a: CHEBI:29281 ! alkyl sulfate [Term] id: CHEBI:45616 name: (R)-1-phenylethanol subset: chebi_ph7_3 is_a: CHEBI:669 ! 1-phenylethanol relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:456215 name: adenosine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:456216 name: ADP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:45630 name: 4-oxopentanoic acid is_a: CHEBI:25799 ! oxopentanoic acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45696 name: hydrogensulfate is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:45713 name: trans-resveratrol subset: chebi_ph7_3 is_a: CHEBI:27881 ! resveratrol relationship: has_role CHEBI:138977 ! quorum sensing inhibitor relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:26115 ! phytoalexin relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45718 name: 3,3,3-tetramine is_a: CHEBI:39166 ! tetramine is_a: CHEBI:39474 ! polyazaalkane [Term] id: CHEBI:45725 name: spermine(4+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:45744 name: N-acetyl-beta-neuraminic acid is_a: CHEBI:17012 ! N-acetylneuraminic acid relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:45757 name: (5S)-5-(carboxymethyl)-L-proline is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:84186 ! L-proline derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:45764 name: L-methionine (R)-S-oxide residue subset: chebi_ph7_3 is_a: CHEBI:15989 ! L-methionine S-oxide residue [Term] id: CHEBI:4579 name: dihydropinosylvin subset: chebi_ph7_3 is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:51571 ! diphenylethane relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:45791 name: triethylammonium ion subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:45804 name: beta-D-tagatofuranose 6-phosphate is_a: CHEBI:4251 ! D-tagatofuranose 6-phosphate [Term] id: CHEBI:4581 name: 7,8-dihydropteroic acid is_a: CHEBI:38795 ! pteroic acids [Term] id: CHEBI:45815 name: N-octanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:45826 name: N-acetyl-L-threonine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:45863 name: paclitaxel subset: chebi_ph7_3 is_a: CHEBI:50367 ! taxane diterpenoid is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:61950 ! microtubule-stabilising agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:45868 name: dTDP-4-dehydro-beta-L-rhamnose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:45869 name: estriol 3-O-(beta-D-glucuronide) is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:45895 name: tert-butanol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:45906 name: suramin is_a: CHEBI:134043 ! phenylureas is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:36336 ! naphthalenesulfonic acid relationship: has_role CHEBI:35444 ! antinematodal drug relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:36335 ! trypanocidal drug relationship: has_role CHEBI:37700 ! EC 2.7.11.13 (protein kinase C) inhibitor relationship: has_role CHEBI:38999 ! GABA-gated chloride channel antagonist relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:65259 ! GABA antagonist relationship: has_role CHEBI:67114 ! ryanodine receptor agonist relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:91079 ! purinergic receptor P2 antagonist [Term] id: CHEBI:45912 name: D-threonate subset: chebi_ph7_3 is_a: CHEBI:15243 ! threonate [Term] id: CHEBI:4593 name: dihydroxyfumaric acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:45931 name: thiamine(1+) diphosphate(1-) is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:35284 ! ammonium betaine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:45956 name: tristearoylglycerol subset: chebi_ph7_3 is_a: CHEBI:138347 ! triacylglycerol 54:0 relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:45969 name: tricarballylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:45979 name: thiabendazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:38418 ! 1,3-thiazoles is_a: CHEBI:87036 ! benzimidazole fungicide relationship: has_role CHEBI:35444 ! antinematodal drug relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:45996 name: ribothymidine subset: chebi_ph7_3 is_a: CHEBI:25347 ! methyluridine relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46024 name: trichostatin A subset: chebi_ph7_3 is_a: CHEBI:24650 ! hydroxamic acid is_a: CHEBI:39146 ! trichostatin is_a: CHEBI:86478 ! antibiotic antifungal agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:46050 name: docosane subset: chebi_ph7_3 is_a: CHEBI:83563 ! long-chain alkane relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:46053 name: 2,4,6-trinitrotoluene subset: chebi_ph7_3 is_a: CHEBI:27135 ! trinitrotoluene relationship: has_role CHEBI:63490 ! explosive [Term] id: CHEBI:46077 name: 4H-1,2,4-triazole subset: chebi_ph7_3 is_a: CHEBI:35560 ! 1,2,4-triazole [Term] id: CHEBI:46081 name: fluconazole subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38582 ! difluorobenzene is_a: CHEBI:87071 ! conazole antifungal drug is_a: CHEBI:87101 ! triazole antifungal drug relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50183 ! P450 inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:46143 name: UDP-N-acetyl-alpha-muramoyl-L-alanyl-D-glutamic acid is_a: CHEBI:16970 ! UDP-N-acetylmuramoyl-L-alanyl-D-glutamic acid [Term] id: CHEBI:46195 name: paracetamol subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:173085 ! ferroptosis inducer relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50629 ! cyclooxygenase 2 inhibitor relationship: has_role CHEBI:50630 ! cyclooxygenase 1 inhibitor relationship: has_role CHEBI:50908 ! hepatotoxic agent relationship: has_role CHEBI:73263 ! cyclooxygenase 3 inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:46209 name: L-tyrosinal is_a: CHEBI:22492 ! amino aldehyde is_a: CHEBI:33853 ! phenols is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:46229 name: UDP-alpha-D-glucose is_a: CHEBI:18066 ! UDP-D-glucose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:4623 name: (carboxymethyl)(dimethyl)sulfonium is_a: CHEBI:26830 ! sulfonium compound [Term] id: CHEBI:46245 name: coenzyme Q10 subset: chebi_ph7_3 is_a: CHEBI:16389 ! ubiquinones relationship: has_role CHEBI:173084 ! ferroptosis inhibitor relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46252 name: 5,6-diaminouracil subset: chebi_ph7_3 is_a: CHEBI:22532 ! aminouracil is_a: CHEBI:23666 ! diamine is_a: CHEBI:38337 ! pyrimidone [Term] id: CHEBI:46261 name: N-phenylthiourea subset: chebi_ph7_3 is_a: CHEBI:51276 ! thioureas relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor [Term] id: CHEBI:46280 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GalpNAc is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:4629 name: diosgenin subset: chebi_ph7_3 is_a: CHEBI:26606 ! sapogenin is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:46342 name: undecane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane [Term] id: CHEBI:46345 name: 5-fluorouracil subset: chebi_ph7_3 is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:67142 ! nucleobase analogue relationship: has_role CHEBI:132992 ! radiosensitizing agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:4638 name: diphenidol is_a: CHEBI:22712 ! benzenes is_a: CHEBI:26151 ! piperidines is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:50919 ! antiemetic [Term] id: CHEBI:46398 name: UTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46430 name: (S,S,S)-alpha-tocopherol subset: chebi_ph7_3 is_a: CHEBI:22470 ! alpha-tocopherol [Term] id: CHEBI:46442 name: vanadate(3-) is_a: CHEBI:30528 ! vanadium oxoanion is_a: CHEBI:79387 ! trivalent inorganic anion relationship: has_role CHEBI:35608 ! EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor relationship: has_role CHEBI:37153 ! EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor relationship: has_role CHEBI:63332 ! EC 3.1.3.1 (alkaline phosphatase) inhibitor relationship: has_role CHEBI:77024 ! EC 3.1.3.41 (4-nitrophenylphosphatase) inhibitor [Term] id: CHEBI:46470 name: uridine 5'-monophosphate residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:4648 name: hop-22(29)-ene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene [Term] id: CHEBI:46502 name: tungstate subset: chebi_ph7_3 is_a: CHEBI:36270 ! tungsten oxoanion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:46570 name: cis-zeatin subset: chebi_ph7_3 is_a: CHEBI:15333 ! zeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:46574 name: wybutosine subset: chebi_ph7_3 is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:60783 ! nucleoside analogue [Term] id: CHEBI:46611 name: phosphorothioic O,O,O-acid is_a: CHEBI:46612 ! phosphorothioic acid [Term] id: CHEBI:46612 name: phosphorothioic acid is_a: CHEBI:33457 ! phosphorus oxoacid [Term] id: CHEBI:46613 name: phosphorothioic O,O,S-acid is_a: CHEBI:46612 ! phosphorothioic acid [Term] id: CHEBI:46629 name: oxo group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:46633 name: carbapenems is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:27933 ! beta-lactam antibiotic is_a: CHEBI:38101 ! organonitrogen heterocyclic compound relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:46634 name: carbapenemcarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:46633 ! carbapenems [Term] id: CHEBI:46638 name: O-sinapoyl-D-glucaric acid is_a: CHEBI:16681 ! O-sinapoylglucaric acid [Term] id: CHEBI:46640 name: diketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:46644 name: D-altronic acid is_a: CHEBI:33532 ! altronic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:46645 name: isobutanol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:50584 ! alkyl alcohol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:46662 name: mineral is_a: CHEBI:59999 ! chemical substance [Term] id: CHEBI:46668 name: amino acid ester is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:46685 name: oxadiazole is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46686 name: azaalkane is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:46687 name: diazaalkane is_a: CHEBI:39474 ! polyazaalkane [Term] id: CHEBI:46691 name: 2,3-dihydroxy-5-methyl-1,4-benzoquinone is_a: CHEBI:132124 ! 1,4-benzoquinones [Term] id: CHEBI:46695 name: fluorohydrocarbon is_a: CHEBI:24472 ! halohydrocarbon is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:46700 name: benzoxazole is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46701 name: pyrrolidinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:46767 ! pyrrolidinecarboxylic acid [Term] id: CHEBI:46702 name: (-)-geosmin subset: chebi_ph7_3 is_a: CHEBI:46703 ! geosmin [Term] id: CHEBI:46703 name: geosmin is_a: CHEBI:30879 ! alcohol is_a: CHEBI:33654 ! alicyclic compound [Term] id: CHEBI:46705 name: (+)-geosmin subset: chebi_ph7_3 is_a: CHEBI:46703 ! geosmin [Term] id: CHEBI:4672 name: docetaxel anhydrous subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:47868 ! photosensitizing agent [Term] id: CHEBI:46722 name: carbonate ester is_a: CHEBI:23016 ! carbonates is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:46723 name: phosphate mineral is_a: CHEBI:46662 ! mineral [Term] id: CHEBI:46731 name: alkyl diphosphate is_a: CHEBI:22324 ! alkyl phosphate [Term] id: CHEBI:46733 name: oxabicycloalkane is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46734 name: (1E,4S,5E,7R)-germacra-1(10),5-dien-11-ol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:68588 ! germacrane sesquiterpenoid [Term] id: CHEBI:46738 name: glycino group is_a: CHEBI:22332 ! alkylamino group is_a: CHEBI:33717 ! C-terminal proteinogenic amino-acid residue [Term] id: CHEBI:4676 name: dodecanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:50269 ! EC 1.1.1.1 (alcohol dehydrogenase) inhibitor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46761 name: dipeptide is_a: CHEBI:25676 ! oligopeptide [Term] id: CHEBI:46762 name: (E,E,E)-geranylgeraniol subset: chebi_ph7_3 is_a: CHEBI:24229 ! geranylgeraniol [Term] id: CHEBI:46765 name: carbapenem subset: chebi_ph7_3 is_a: CHEBI:46633 ! carbapenems [Term] id: CHEBI:46767 name: pyrrolidinecarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:38260 ! pyrrolidines [Term] id: CHEBI:46770 name: pyrrolidinecarboxamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:38260 ! pyrrolidines [Term] id: CHEBI:46773 name: hydroxypyrrolidine is_a: CHEBI:38260 ! pyrrolidines [Term] id: CHEBI:46774 name: polyether is_a: CHEBI:25698 ! ether [Term] id: CHEBI:46775 name: N-alkylpyrrolidine is_a: CHEBI:38260 ! pyrrolidines is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:46786 name: diether is_a: CHEBI:46774 ! polyether [Term] id: CHEBI:46787 name: solvent is_a: CHEBI:33232 ! application is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:468 name: poly[(1->4)-beta-D-mannuronic acid] is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:46800 name: ethanethioic O-acid is_a: CHEBI:26952 ! thioacetic acid [Term] id: CHEBI:46811 name: 2,6-dihydroxy-7,9-dihydro-8H-purin-8-one subset: chebi_ph7_3 is_a: CHEBI:27226 ! uric acid [Term] id: CHEBI:46812 name: 1,3-oxazoles is_a: CHEBI:35790 ! oxazole [Term] id: CHEBI:46814 name: 9H-purine-2,6,8-triol subset: chebi_ph7_3 is_a: CHEBI:27226 ! uric acid [Term] id: CHEBI:46817 name: 7H-purine-2,6,8-triol subset: chebi_ph7_3 is_a: CHEBI:27226 ! uric acid [Term] id: CHEBI:46818 name: urate anion is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46819 name: urate salt is_a: CHEBI:24868 ! organic salt relationship: has_part CHEBI:46818 ! urate anion [Term] id: CHEBI:46820 name: 2,6,8-trihydroxypurin-7-ide is_a: CHEBI:30848 ! urate(1-) [Term] id: CHEBI:46821 name: 6,8-dioxo-6,7,8,9-tetrahydro-1H-purin-2-olate is_a: CHEBI:30848 ! urate(1-) [Term] id: CHEBI:46822 name: 2,8-dihydroxy-1H-purin-6-olate is_a: CHEBI:30848 ! urate(1-) [Term] id: CHEBI:46823 name: 1H-purine-2,6,8-triol is_a: CHEBI:27226 ! uric acid [Term] id: CHEBI:46824 name: 2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-olate is_a: CHEBI:30848 ! urate(1-) [Term] id: CHEBI:46825 name: 6-oxo-6,7-dihydro-1H-purine-2,8-diolate is_a: CHEBI:27216 ! urate(2-) [Term] id: CHEBI:46826 name: 2,6,8-trioxo-3,6,8,9-tetrahydro-2H-purine-1,7-diide is_a: CHEBI:27216 ! urate(2-) [Term] id: CHEBI:46827 name: carboxypyridinecarboxylate is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:46828 name: quinolinate(1-) is_a: CHEBI:132942 ! quinolinate is_a: CHEBI:46827 ! carboxypyridinecarboxylate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46832 name: 3-carboxypyridine-2-carboxylate is_a: CHEBI:46828 ! quinolinate(1-) [Term] id: CHEBI:46833 name: 2-carboxypyridine-3-carboxylate is_a: CHEBI:46828 ! quinolinate(1-) [Term] id: CHEBI:46835 name: dipicolinate(1-) is_a: CHEBI:46827 ! carboxypyridinecarboxylate [Term] id: CHEBI:46837 name: dipicolinic acid is_a: CHEBI:36112 ! pyridinedicarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:46838 name: cyclic carbonate ester is_a: CHEBI:46722 ! carbonate ester [Term] id: CHEBI:46842 name: sarcosinium is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46845 name: N-alkylpiperazine is_a: CHEBI:26144 ! piperazines is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:46846 name: piperazinone is_a: CHEBI:26144 ! piperazines [Term] id: CHEBI:46847 name: N-iminopiperazine is_a: CHEBI:26144 ! piperazines [Term] id: CHEBI:46848 name: N-arylpiperazine is_a: CHEBI:26144 ! piperazines is_a: CHEBI:33860 ! aromatic amine is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:46851 name: N-(2-hydroxyethyl)piperazine is_a: CHEBI:23981 ! ethanolamines is_a: CHEBI:46845 ! N-alkylpiperazine [Term] id: CHEBI:46853 name: piperazinecarboxamide is_a: CHEBI:26144 ! piperazines is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:46854 name: L-glutamo group is_a: CHEBI:24321 ! glutamo group is_a: CHEBI:33717 ! C-terminal proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:46855 name: L-alpha-glutamyl group is_a: CHEBI:22453 ! alpha-glutamyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue [Term] id: CHEBI:46856 name: 11-cis-retinoic acid is_a: CHEBI:26536 ! retinoic acid [Term] id: CHEBI:46858 name: L-tyrosine residue subset: chebi_ph7_3 is_a: CHEBI:32789 ! tyrosine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:46860 name: cinchomeronic acid is_a: CHEBI:36112 ! pyridinedicarboxylic acid [Term] id: CHEBI:46861 name: cinchomeronate(2-) subset: chebi_ph7_3 is_a: CHEBI:36173 ! pyridinedicarboxylate [Term] id: CHEBI:46862 name: cinchomeronate(1-) is_a: CHEBI:46827 ! carboxypyridinecarboxylate [Term] id: CHEBI:46863 name: 4-carboxypyridine-3-carboxylate is_a: CHEBI:46862 ! cinchomeronate(1-) [Term] id: CHEBI:46864 name: 3-carboxypyridine-4-carboxylate is_a: CHEBI:46862 ! cinchomeronate(1-) [Term] id: CHEBI:46867 name: indolyl carboxylic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:46874 name: alpha-amino acid ester is_a: CHEBI:46668 ! amino acid ester [Term] id: CHEBI:46883 name: carboxy group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:46890 name: silicon hydroxide is_a: CHEBI:26677 ! silicon molecular entity [Term] id: CHEBI:46891 name: azetidinecarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:46895 name: lipopeptide is_a: CHEBI:16670 ! peptide is_a: CHEBI:18059 ! lipid [Term] id: CHEBI:46896 name: diacyl lipopeptide is_a: CHEBI:46895 ! lipopeptide [Term] id: CHEBI:46898 name: cholesteryl oleate subset: chebi_ph7_3 is_a: CHEBI:183800 ! CE(18:1) is_a: CHEBI:46900 ! cholesteryl octadec-9-enoate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:46900 name: cholesteryl octadec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:132001 ! cholesteryl octadecenoate [Term] id: CHEBI:46903 name: cholesteryl octadeca-9,12-dienoate subset: chebi_ph7_3 is_a: CHEBI:132002 ! cholesteryl octadecadienoate [Term] id: CHEBI:46904 name: oxalate(1-) is_a: CHEBI:132952 ! oxalate is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46905 name: (R)-pantothenic acid is_a: CHEBI:176840 ! vitamin B5 is_a: CHEBI:7916 ! pantothenic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:74530 ! antidote to curare poisoning relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:46911 name: L-ornithinium(1+) subset: chebi_ph7_3 is_a: CHEBI:46912 ! ornithinium(1+) is_a: CHEBI:62031 ! polar amino acid zwitterion [Term] id: CHEBI:46912 name: ornithinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46913 name: ornithinium(2+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:46914 name: L-ornithinate is_a: CHEBI:32964 ! ornithinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46915 name: sarcosinate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:46920 name: N-methylpiperazine is_a: CHEBI:46845 ! N-alkylpiperazine is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:46939 name: indolyl carboxylate ester is_a: CHEBI:24828 ! indoles is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:46940 name: indanes is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:46941 name: oxane subset: chebi_ph7_3 is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:46942 ! oxanes [Term] id: CHEBI:46942 name: oxanes is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46951 name: 3-(2,3-dihydroxyphenyl)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:46952 name: oxazinane is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46953 name: alpha-D-galactoside subset: chebi_ph7_3 is_a: CHEBI:20961 ! D-galactoside [Term] id: CHEBI:46954 name: thiazinane is_a: CHEBI:25693 ! organic heteromonocyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:46955 name: anthracenes is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:51269 ! acenes [Term] id: CHEBI:46957 name: 3-(2-hydroxyphenyl)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:46959 name: N-acylazetidine is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:38777 ! azetidines [Term] id: CHEBI:46960 name: dTMP(-) is_a: CHEBI:15245 ! thymidine 5'-monophosphate [Term] id: CHEBI:46961 name: phytosphingosine is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:27136 ! triol is_a: CHEBI:35785 ! sphingoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:46963 name: 2-aminooctadecene-1,3-diol is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:46964 name: 2-aminooctadec-4-ene-1,3-diol is_a: CHEBI:46963 ! 2-aminooctadecene-1,3-diol [Term] id: CHEBI:46965 name: (2R,3S)-2-aminooctadec-4-ene-1,3-diol is_a: CHEBI:46964 ! 2-aminooctadec-4-ene-1,3-diol [Term] id: CHEBI:46966 name: 2-amino-1-hydroxyoctadecan-3-one is_a: CHEBI:17087 ! ketone is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:46967 name: L-erythro-sphingosine is_a: CHEBI:46965 ! (2R,3S)-2-aminooctadec-4-ene-1,3-diol [Term] id: CHEBI:46968 name: 2-aminooctadecane-1,3-diol is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:46969 name: benzoxazine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:46970 name: phytosphingosine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:46971 name: premnaspirodiene subset: chebi_ph7_3 is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:46976 name: 1,4-thiazine is_a: CHEBI:38326 ! thiazine [Term] id: CHEBI:46978 name: thiazinemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38326 ! thiazine [Term] id: CHEBI:46979 name: N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:46981 name: N-acetylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate [Term] id: CHEBI:46987 name: alpha-L-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:17535 ! L-arabinopyranose [Term] id: CHEBI:46988 name: 4-amino-4-deoxyarabinose is_a: CHEBI:46989 ! pentosamine [Term] id: CHEBI:46989 name: pentosamine is_a: CHEBI:60926 ! amino monosaccharide [Term] id: CHEBI:46990 name: 4-amino-4-deoxy-L-arabinose is_a: CHEBI:46988 ! 4-amino-4-deoxyarabinose [Term] id: CHEBI:46991 name: 4-amino-4-deoxy-L-arabinopyranose is_a: CHEBI:46990 ! 4-amino-4-deoxy-L-arabinose [Term] id: CHEBI:46992 name: 4-amino-4-deoxy-alpha-L-arabinopyranose is_a: CHEBI:46991 ! 4-amino-4-deoxy-L-arabinopyranose [Term] id: CHEBI:46993 name: 4-amino-4-deoxy-beta-L-arabinopyranose is_a: CHEBI:46991 ! 4-amino-4-deoxy-L-arabinopyranose [Term] id: CHEBI:46994 name: D-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:17108 ! D-arabinose [Term] id: CHEBI:46995 name: alpha-D-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:46994 ! D-arabinopyranose [Term] id: CHEBI:46996 name: beta-D-arabinopyranose subset: chebi_ph7_3 is_a: CHEBI:46994 ! D-arabinopyranose [Term] id: CHEBI:46997 name: L-ribose is_a: CHEBI:33942 ! ribose [Term] id: CHEBI:46998 name: ribofuranose is_a: CHEBI:33942 ! ribose relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:47000 name: L-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:46997 ! L-ribose is_a: CHEBI:46998 ! ribofuranose [Term] id: CHEBI:47002 name: beta-D-ribose subset: chebi_ph7_3 is_a: CHEBI:47013 ! D-ribofuranose [Term] id: CHEBI:47003 name: leucine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:47004 name: alpha-L-ribose subset: chebi_ph7_3 is_a: CHEBI:47000 ! L-ribofuranose [Term] id: CHEBI:47005 name: beta-L-ribose subset: chebi_ph7_3 is_a: CHEBI:47000 ! L-ribofuranose [Term] id: CHEBI:47006 name: D-ribopyranose subset: chebi_ph7_3 is_a: CHEBI:16988 ! D-ribose is_a: CHEBI:47007 ! ribopyranose [Term] id: CHEBI:47007 name: ribopyranose is_a: CHEBI:33942 ! ribose [Term] id: CHEBI:47010 name: L-ribopyranose subset: chebi_ph7_3 is_a: CHEBI:46997 ! L-ribose is_a: CHEBI:47007 ! ribopyranose [Term] id: CHEBI:47012 name: beta-L-ribopyranose subset: chebi_ph7_3 is_a: CHEBI:47010 ! L-ribopyranose [Term] id: CHEBI:47013 name: D-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:16988 ! D-ribose is_a: CHEBI:46998 ! ribofuranose [Term] id: CHEBI:47014 name: aldehydo-D-ribose subset: chebi_ph7_3 is_a: CHEBI:16988 ! D-ribose is_a: CHEBI:47024 ! aldehydo-ribose [Term] id: CHEBI:47015 name: aldehydo-L-ribose subset: chebi_ph7_3 is_a: CHEBI:46997 ! L-ribose is_a: CHEBI:47024 ! aldehydo-ribose [Term] id: CHEBI:47016 name: tetrahydrofuranone is_a: CHEBI:26912 ! oxolanes [Term] id: CHEBI:47017 name: tetrahydrofuranol is_a: CHEBI:26912 ! oxolanes [Term] id: CHEBI:47018 name: monohydroxytetrahydrofuran is_a: CHEBI:47017 ! tetrahydrofuranol [Term] id: CHEBI:47019 name: dihydroxytetrahydrofuran is_a: CHEBI:47017 ! tetrahydrofuranol [Term] id: CHEBI:47022 name: tetrahydrofurandione is_a: CHEBI:47016 ! tetrahydrofuranone [Term] id: CHEBI:47024 name: aldehydo-ribose is_a: CHEBI:33942 ! ribose [Term] id: CHEBI:47025 name: UDP-4-amino-4-deoxy-beta-L-arabinopyranose is_a: CHEBI:35262 ! UDP-amino sugar relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:47027 name: UDP-4-deoxy-4-formamido-beta-L-arabinopyranose is_a: CHEBI:35262 ! UDP-amino sugar relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:47028 name: UDP-beta-L-threo-pentopyranos-4-ulose is_a: CHEBI:17297 ! UDP-sugar relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:47031 name: LL-2,6-diaminopimelate(2-) is_a: CHEBI:23671 ! 2,6-diaminopimelate(2-) [Term] id: CHEBI:47037 name: cyclic purine dinucleotide is_a: CHEBI:36982 ! cyclic purine nucleotide [Term] id: CHEBI:47039 name: 4-amino-4-deoxy-alpha-L-arabinopyranosyl undecaprenyl phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:47040 name: lipid A is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:47041 name: tetrahydroxytetrahydrofuran is_a: CHEBI:47017 ! tetrahydrofuranol [Term] id: CHEBI:47042 name: hydroxycalciol is_a: CHEBI:36853 ! hydroxy seco-steroid [Term] id: CHEBI:4705 name: double-stranded DNA is_a: CHEBI:16991 ! deoxyribonucleic acid [Term] id: CHEBI:4712 name: doxercalciferol subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D is_a: CHEBI:36853 ! hydroxy seco-steroid relationship: has_role CHEBI:50188 ! provitamin relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:71212 ! prohormone [Term] id: CHEBI:47133 name: 5'-chloro-5'-deoxyadenosine subset: chebi_ph7_3 is_a: CHEBI:22260 ! adenosines [Term] id: CHEBI:47136 name: pentachlorobenzene subset: chebi_ph7_3 is_a: CHEBI:83390 ! pentachlorobenzenes relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:47214 name: (23S)-23,25-dihydroxycalciol subset: chebi_ph7_3 is_a: CHEBI:47042 ! hydroxycalciol [Term] id: CHEBI:47266 name: hydrogen bromide is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:18140 ! hydrogen halide is_a: CHEBI:37176 ! mononuclear parent hydride relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:47291 name: 3-chloro-D-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:4735 name: ethylenediaminetetraacetic acid is_a: CHEBI:31577 ! ethylenediamine derivative is_a: CHEBI:35742 ! tetracarboxylic acid is_a: CHEBI:60892 ! polyamino carboxylic acid relationship: has_role CHEBI:166831 ! copper chelator relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:50247 ! antidote relationship: has_role CHEBI:50249 ! anticoagulant [Term] id: CHEBI:47356 name: 7-chloro-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:55354 ! 7-chlorotryptophan is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:47395 name: devancoaminyl vancomycin is_a: CHEBI:24396 ! glycopeptide is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:4743 name: ecgonine is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:4746 name: echinenone subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:47537 name: L-glucaric acid is_a: CHEBI:17301 ! glucaric acid [Term] id: CHEBI:47571 name: N-acetyl-alpha-D-muramic acid is_a: CHEBI:21615 ! N-acetyl-D-muramic acid [Term] id: CHEBI:47600 name: purvalanol A subset: chebi_ph7_3 is_a: CHEBI:38934 ! purvalanol [Term] id: CHEBI:47622 name: acetate ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:4767 name: Elastin is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:47693 name: keto-D-tagatose subset: chebi_ph7_3 is_a: CHEBI:16443 ! D-tagatose [Term] id: CHEBI:47724 name: vancomycin aglycone is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37407 ! cyclic ether relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:47762 name: phosphoethanolamine-Kdo2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:47763 name: beta-L-Ara4N-lipid A is_a: CHEBI:25051 ! lipid As relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:47771 name: beta-tocopherol subset: chebi_ph7_3 is_a: CHEBI:27013 ! tocopherol is_a: CHEBI:33234 ! vitamin E relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:47772 name: delta-tocopherol subset: chebi_ph7_3 is_a: CHEBI:27013 ! tocopherol is_a: CHEBI:33234 ! vitamin E relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77962 ! food antioxidant [Term] id: CHEBI:47773 name: very-low-density lipoprotein cholesterol is_a: CHEBI:50404 ! lipoprotein cholesterol [Term] id: CHEBI:47774 name: low-density lipoprotein cholesterol is_a: CHEBI:50404 ! lipoprotein cholesterol [Term] id: CHEBI:47775 name: high-density lipoprotein cholesterol is_a: CHEBI:50404 ! lipoprotein cholesterol [Term] id: CHEBI:47776 name: very-low-density lipoprotein triglyceride is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:47777 name: 1,3-diglyceride subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:47778 name: glyceride is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:47779 name: aminoglycoside is_a: CHEBI:24400 ! glycoside is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:47781 name: desipramine is_a: CHEBI:47804 ! dibenzoazepine is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:35640 ! adrenergic uptake inhibitor relationship: has_role CHEBI:37890 ! alpha-adrenergic antagonist relationship: has_role CHEBI:37955 ! H1-receptor antagonist relationship: has_role CHEBI:48873 ! cholinergic antagonist relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor relationship: has_role CHEBI:76811 ! EC 3.1.4.12 (sphingomyelin phosphodiesterase) inhibitor relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:47783 name: cyclopentafuran is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:47784 name: nucleotide conjugate is_a: CHEBI:61120 ! nucleobase-containing molecular entity [Term] id: CHEBI:47786 name: 16-oxo steroid subset: chebi_ph7_3 is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:47787 name: 11-oxo steroid subset: chebi_ph7_3 is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:47788 name: 3-oxo steroid subset: chebi_ph7_3 is_a: CHEBI:35789 ! oxo steroid is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:47789 name: 7-oxo steroid subset: chebi_ph7_3 is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:47790 name: furofuran is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:47791 name: phenylacetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:22307 ! aldoxime [Term] id: CHEBI:47793 name: (E)-phenylacetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:47791 ! phenylacetaldehyde oxime [Term] id: CHEBI:47794 name: dihydrocamalexic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38418 ! 1,3-thiazoles is_a: CHEBI:83991 ! imidothioate [Term] id: CHEBI:47795 name: (R)-dihydrocamalexic acid is_a: CHEBI:47794 ! dihydrocamalexic acid [Term] id: CHEBI:47796 name: (S)-dihydrocamalexic acid is_a: CHEBI:47794 ! dihydrocamalexic acid [Term] id: CHEBI:47798 name: xi-progoitrin(1-) subset: chebi_ph7_3 is_a: CHEBI:62663 ! hydroxy-alkenylglucosinolate [Term] id: CHEBI:47799 name: calcitetrol subset: chebi_ph7_3 is_a: CHEBI:47042 ! hydroxycalciol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:47804 name: dibenzoazepine is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:47805 name: 25-hydroxy-24-oxocalciol subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol [Term] id: CHEBI:47806 name: oxocalciol is_a: CHEBI:47836 ! oxo seco-steroid [Term] id: CHEBI:47811 name: penamcarboxylate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:35992 ! penams [Term] id: CHEBI:47812 name: (1S)-1,25-dihydroxy-24-oxocalciol subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:47813 name: (1S)-1,23,25-trihydroxy-24-oxocalciol subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:47818 name: (1S)-1,23-dihydroxy-24,25,26,27-tetranorcalciol subset: chebi_ph7_3 is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol [Term] id: CHEBI:47819 name: N(5)-[amino(hydroxyimino)methyl]-L-ornithine is_a: CHEBI:28538 ! N(omega)-hydroxy-L-arginine is_a: CHEBI:47826 ! N(5)-[amino(hydroxyimino)methyl]ornithine [Term] id: CHEBI:47820 name: (1S)-1-hydroxy-23-oxo-24,25,26,27-tetranorcalciol subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol [Term] id: CHEBI:47821 name: N(5)-[(E)-amino(hydroxyimino)methyl]-L-ornithine is_a: CHEBI:47819 ! N(5)-[amino(hydroxyimino)methyl]-L-ornithine is_a: CHEBI:47825 ! N(5)-[(E)-amino(hydroxyimino)methyl]ornithine [Term] id: CHEBI:47822 name: N(5)-[(Z)-amino(hydroxyimino)methyl]-L-ornithine is_a: CHEBI:47819 ! N(5)-[amino(hydroxyimino)methyl]-L-ornithine is_a: CHEBI:7101 ! N(5)-[(Z)-amino(hydroxyimino)methyl]ornithine [Term] id: CHEBI:47823 name: N(omega)-hydroxyarginine is_a: CHEBI:47830 ! hydroxyarginine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:47825 name: N(5)-[(E)-amino(hydroxyimino)methyl]ornithine is_a: CHEBI:47826 ! N(5)-[amino(hydroxyimino)methyl]ornithine [Term] id: CHEBI:47826 name: N(5)-[amino(hydroxyimino)methyl]ornithine is_a: CHEBI:47823 ! N(omega)-hydroxyarginine [Term] id: CHEBI:47827 name: N(5)-[(hydroxyamino)(imino)methyl]ornithine is_a: CHEBI:47823 ! N(omega)-hydroxyarginine [Term] id: CHEBI:47828 name: calcitroic acid is_a: CHEBI:47042 ! hydroxycalciol [Term] id: CHEBI:47830 name: hydroxyarginine is_a: CHEBI:24662 ! hydroxy-amino acid [Term] id: CHEBI:47833 name: methionine sulfoximine is_a: CHEBI:25230 ! methionine derivative is_a: CHEBI:38084 ! sulfoximide is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:47836 name: oxo seco-steroid is_a: CHEBI:35788 ! seco-steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:47843 name: dithiane is_a: CHEBI:51652 ! dithianes [Term] id: CHEBI:47844 name: 1,2-dithiane subset: chebi_ph7_3 is_a: CHEBI:47843 ! dithiane [Term] id: CHEBI:47857 name: ureas is_a: CHEBI:33256 ! primary amide [Term] id: CHEBI:47858 name: 1-piperideine is_a: CHEBI:26145 ! piperideine [Term] id: CHEBI:47867 name: indicator is_a: CHEBI:33232 ! application [Term] id: CHEBI:47868 name: photosensitizing agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:47869 name: thioglycolate(2-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:47870 name: (methylthio)acetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:86315 ! methyl sulfide relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:47871 name: mercaptopropanoic acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid [Term] id: CHEBI:47877 name: hexose 6-phosphate is_a: CHEBI:47878 ! hexose phosphate [Term] id: CHEBI:47878 name: hexose phosphate is_a: CHEBI:33447 ! phospho sugar is_a: CHEBI:63385 ! hexose derivative [Term] id: CHEBI:47879 name: 3-hydroxymethylcephalosporin is_a: CHEBI:23066 ! cephalosporin [Term] id: CHEBI:47880 name: steroid ester is_a: CHEBI:35341 ! steroid is_a: CHEBI:35701 ! ester [Term] id: CHEBI:47881 name: 3-oxo monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:47882 name: cyclic polypyrrole is_a: CHEBI:38077 ! polypyrrole [Term] id: CHEBI:47885 name: dinucleotide is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:47891 name: steroid acid is_a: CHEBI:35341 ! steroid is_a: CHEBI:64709 ! organic acid [Term] id: CHEBI:47892 name: 4'-O-beta-D-glucosyl-cis-p-coumarate subset: chebi_ph7_3 is_a: CHEBI:47893 ! 4-O-beta-D-glucosyl-4-coumarate [Term] id: CHEBI:47893 name: 4-O-beta-D-glucosyl-4-coumarate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:47896 name: pyridine nucleoside is_a: CHEBI:33838 ! nucleoside is_a: CHEBI:36979 ! N-glycosylpyridine [Term] id: CHEBI:47898 name: 4'-epidoxorubicin is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor [Term] id: CHEBI:47899 name: red chlorophyll catabolite is_a: CHEBI:36735 ! biladienes [Term] id: CHEBI:47901 name: alkanesulfonic acid is_a: CHEBI:33551 ! organosulfonic acid relationship: has_part CHEBI:22323 ! alkyl group [Term] id: CHEBI:47902 name: idopyranuronic acid is_a: CHEBI:24769 ! iduronic acid [Term] id: CHEBI:47903 name: L-idopyranuronic acid is_a: CHEBI:47902 ! idopyranuronic acid is_a: CHEBI:85187 ! L-iduronic acid [Term] id: CHEBI:47904 name: 4-maleylacetoacetic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:47905 name: coniferyl acetate subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:64292 ! coniferyl ester [Term] id: CHEBI:47907 name: 3-oxo-Delta(5)-steroid subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:47908 name: alkanethiol subset: chebi_ph7_3 is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:47909 name: 3-oxo-Delta(4) steroid subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:51689 ! enone relationship: has_part CHEBI:136849 ! 3-oxo-Delta(4)-steroid group [Term] id: CHEBI:47910 name: S-substituted L-cysteine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:47911 name: S-substituted N-acetyl-L-cysteine is_a: CHEBI:22160 ! acetamides is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:47912 name: S-organyl-L-cysteine is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:47910 ! S-substituted L-cysteine [Term] id: CHEBI:47913 name: S-hydrocarbyl-L-cysteine is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:47912 ! S-organyl-L-cysteine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:47914 name: S-prenyl-L-cysteine is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:47913 ! S-hydrocarbyl-L-cysteine is_a: CHEBI:60941 ! prenylcysteine [Term] id: CHEBI:47915 name: S-alkyl-L-cysteine subset: chebi_ph7_3 is_a: CHEBI:47913 ! S-hydrocarbyl-L-cysteine [Term] id: CHEBI:47916 name: flavonoid is_a: CHEBI:72544 ! flavonoids [Term] id: CHEBI:47917 name: 1-ribosylbenzimidazole is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:22715 ! benzimidazoles [Term] id: CHEBI:47921 name: cis-2-coumarate subset: chebi_ph7_3 is_a: CHEBI:11594 ! 2-coumarate [Term] id: CHEBI:47923 name: tripeptide is_a: CHEBI:25676 ! oligopeptide [Term] id: CHEBI:47925 name: 3-coumaric acid is_a: CHEBI:23401 ! coumaric acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:47927 name: 3-coumarate subset: chebi_ph7_3 is_a: CHEBI:23399 ! coumarate [Term] id: CHEBI:47928 name: trans-3-coumarate subset: chebi_ph7_3 is_a: CHEBI:47927 ! 3-coumarate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:47931 name: beta-D-glucosyl-(1->4)-D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:47933 ! D-glucopyranosyl-(1->4)-D-mannopyranose [Term] id: CHEBI:47932 name: D-glucosyl-(1->4)-D-mannose is_a: CHEBI:21010 ! D-glucosyl-D-mannose [Term] id: CHEBI:47933 name: D-glucopyranosyl-(1->4)-D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:47932 ! D-glucosyl-(1->4)-D-mannose [Term] id: CHEBI:47940 name: 4,6-dioxohept-2-enedioic acid is_a: CHEBI:24522 ! heptenedioic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:67265 ! beta-diketone [Term] id: CHEBI:47941 name: 4,6-dioxohept-2-enedioate subset: chebi_ph7_3 is_a: CHEBI:24521 ! heptenedioate is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:47942 name: pantetheine 4'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:67051 ! phosphopantetheine anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:47947 name: keto-D-tagatose 6-phosphate is_a: CHEBI:17837 ! D-tagatose 6-phosphate [Term] id: CHEBI:47950 name: keto-D-fructuronic acid is_a: CHEBI:20937 ! D-fructuronic acid [Term] id: CHEBI:47951 name: primary fluorescent chlorophyll catabolite is_a: CHEBI:36736 ! bilenes relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:47952 name: D-glucopyranuronic acid is_a: CHEBI:4178 ! D-glucuronic acid relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:47953 name: aldehydo-D-glucuronic acid is_a: CHEBI:4178 ! D-glucuronic acid [Term] id: CHEBI:47954 name: beta-D-galacturonic acid is_a: CHEBI:4153 ! D-galactopyranuronic acid [Term] id: CHEBI:47955 name: (2R)-phycocyanobilin is_a: CHEBI:48863 ! phycocyanobilin [Term] id: CHEBI:47956 name: thiocarboxamide is_a: CHEBI:33256 ! primary amide [Term] id: CHEBI:47957 name: (3E)-phycocyanobilin is_a: CHEBI:47955 ! (2R)-phycocyanobilin [Term] id: CHEBI:47958 name: nicotinic acetylcholine receptor agonist is_a: CHEBI:38324 ! cholinergic agonist [Term] id: CHEBI:47959 name: 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:47960 name: (2E,4Z)-5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid is_a: CHEBI:47959 ! 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylic acid [Term] id: CHEBI:47961 name: (2E,4Z)-5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate(3-) subset: chebi_ph7_3 is_a: CHEBI:12113 ! 5-hydroxypenta-2,4-diene-1,2,5-tricarboxylate(3-) [Term] id: CHEBI:47962 name: aldehydo-D-galacturonic acid is_a: CHEBI:18024 ! D-galacturonic acid [Term] id: CHEBI:47964 name: aurone subset: chebi_ph7_3 is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:72576 ! aurones [Term] id: CHEBI:47965 name: N-acetylmuramic acid is_a: CHEBI:25432 ! muramic acids [Term] id: CHEBI:47967 name: N-acetyl-beta-muramic acid 6-phosphate is_a: CHEBI:47968 ! N-acetylmuramic acid 6-phosphate [Term] id: CHEBI:47968 name: N-acetylmuramic acid 6-phosphate is_a: CHEBI:25432 ! muramic acids relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:47977 name: 2-amino-2-deoxy-D-glucopyranose is_a: CHEBI:17315 ! D-glucosamine relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:47978 name: N-acetylmuramate is_a: CHEBI:33985 ! muramates [Term] id: CHEBI:47979 name: N-acetyl-alpha-muramate subset: chebi_ph7_3 is_a: CHEBI:28881 ! 2-acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-D-glucopyranose [Term] id: CHEBI:47980 name: threo-3-methyl-L-aspartic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:47982 name: pantetheine 4'-phosphate group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:47985 name: enol ether subset: chebi_ph7_3 is_a: CHEBI:25698 ! ether is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:47987 name: 2-amino-2-deoxy-D-glucopyranose 6-phosphate is_a: CHEBI:12962 ! D-glucosamine 6-phosphate [Term] id: CHEBI:47989 name: enamine is_a: CHEBI:32952 ! amine is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:47990 name: N-hydroxy-L-phenylalanine is_a: CHEBI:84144 ! L-phenylalanine derivative [Term] id: CHEBI:47991 name: N,N-dihydroxy-L-phenylalanine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid is_a: CHEBI:84144 ! L-phenylalanine derivative [Term] id: CHEBI:47992 name: N-hydroxy-L-tryptophan is_a: CHEBI:47995 ! hydroxy-L-tryptophan [Term] id: CHEBI:47993 name: N,N-dihydroxy-L-tryptophan is_a: CHEBI:47996 ! dihydroxy-L-tryptophan is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:47994 name: L-tryptophan derivative is_a: CHEBI:27164 ! tryptophan derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:47995 name: hydroxy-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:84194 ! hydroxytryptophan [Term] id: CHEBI:47996 name: dihydroxy-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative [Term] id: CHEBI:47997 name: D-tryptophan derivative is_a: CHEBI:27164 ! tryptophan derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:48000 name: 5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole is_a: CHEBI:37292 ! 1-(phosphoribosyl)imidazole relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:48001 name: protein synthesis inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:48005 name: gamma-L-glutamylputrescine is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:48006 ! gamma-glutamylputrescine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:48006 name: gamma-glutamylputrescine is_a: CHEBI:70813 ! glutamine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:48007 name: N-[(E)-4-aminobutylidene]propane-1,3-diamine is_a: CHEBI:24783 ! imine [Term] id: CHEBI:48024 name: 3'-hydroxyflavanones is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:48025 name: 3',5'-dihydroxyflavanone subset: chebi_ph7_3 is_a: CHEBI:38749 ! dihydroxyflavanone is_a: CHEBI:48024 ! 3'-hydroxyflavanones [Term] id: CHEBI:48027 name: (-)-dihydromyricetin subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:28917 ! dihydromyricetin [Term] id: CHEBI:48029 name: 4-methyleneglutamic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:48030 name: tetrapeptide is_a: CHEBI:25676 ! oligopeptide [Term] id: CHEBI:48031 name: 4-methylene-L-glutamic acid is_a: CHEBI:48029 ! 4-methyleneglutamic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:48032 name: 4-methylene-D-glutamic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:48029 ! 4-methyleneglutamic acid [Term] id: CHEBI:48033 name: cobyrinic acid a,c diamide is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:48034 name: cob(III)yrinic acid a,c diamide is_a: CHEBI:48033 ! cobyrinic acid a,c diamide [Term] id: CHEBI:48039 name: dihydroflavonols subset: chebi_ph7_3 is_a: CHEBI:24697 ! hydroxyflavanone [Term] id: CHEBI:48040 name: 2,3-dihydroflavon-3-ol subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:48039 ! dihydroflavonols [Term] id: CHEBI:48041 name: microcystin is_a: CHEBI:24533 ! heterodetic cyclic peptide relationship: has_role CHEBI:50908 ! hepatotoxic agent relationship: has_role CHEBI:88048 ! cyanotoxin [Term] id: CHEBI:48043 name: (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid is_a: CHEBI:18402 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid [Term] id: CHEBI:48052 name: 2,3-dihydrodipicolinic acid is_a: CHEBI:23741 ! dihydrodipicolinic acid [Term] id: CHEBI:48058 name: buten-2-one subset: chebi_ph7_3 is_a: CHEBI:51689 ! enone is_a: CHEBI:51867 ! methyl ketone [Term] id: CHEBI:4806 name: (-)-epigallocatechin 3-gallate subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37576 ! gallate ester is_a: CHEBI:38672 ! flavans relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:63962 ! Hsp90 inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48066 name: D-mannopyranose 6-phosphate is_a: CHEBI:17369 ! D-mannose 6-phosphate is_a: CHEBI:61667 ! D-hexopyranose 6-phosphate [Term] id: CHEBI:48068 name: (S)-5-oxo-2,5-dihydro-2-furylacetic acid is_a: CHEBI:18080 ! 5-oxo-2,5-dihydro-2-furylacetic acid [Term] id: CHEBI:48069 name: (R)-5-oxo-2,5-dihydro-2-furylacetic acid is_a: CHEBI:18080 ! 5-oxo-2,5-dihydro-2-furylacetic acid [Term] id: CHEBI:48070 name: 12-oxo steroid is_a: CHEBI:35789 ! oxo steroid [Term] id: CHEBI:48080 name: brefeldin A subset: chebi_ph7_3 is_a: CHEBI:25105 ! macrolide antibiotic relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:48081 name: bacteriocin is_a: CHEBI:25903 ! peptide antibiotic [Term] id: CHEBI:48092 name: L-xylonic acid is_a: CHEBI:33828 ! xylonic acid [Term] id: CHEBI:48093 name: D-xylonic acid is_a: CHEBI:33828 ! xylonic acid [Term] id: CHEBI:48094 name: D-aspartic acid residue is_a: CHEBI:32470 ! aspartic acid residue [Term] id: CHEBI:48095 name: keto-D-fructose subset: chebi_ph7_3 is_a: CHEBI:15824 ! D-fructose is_a: CHEBI:37723 ! keto-fructose [Term] id: CHEBI:48096 name: D-glutamic acid residue is_a: CHEBI:32483 ! glutamic acid residue [Term] id: CHEBI:48097 name: D-glutamine residue is_a: CHEBI:32677 ! glutamine residue [Term] id: CHEBI:48107 name: nitric acid is_a: CHEBI:33455 ! nitrogen oxoacid relationship: has_role CHEBI:33893 ! reagent relationship: has_role CHEBI:48356 ! protic solvent [Term] id: CHEBI:48109 name: nitrobenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:48110 name: trinitrobenzene is_a: CHEBI:48109 ! nitrobenzenes [Term] id: CHEBI:48113 name: 1,3,5-trinitrobenzene subset: chebi_ph7_3 is_a: CHEBI:48110 ! trinitrobenzene relationship: has_role CHEBI:63490 ! explosive [Term] id: CHEBI:48116 name: nucleotide-amino acid is_a: CHEBI:36976 ! nucleotide is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:48117 name: 1-glycosylimidazole is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:24780 ! imidazoles [Term] id: CHEBI:48120 name: anthracycline is_a: CHEBI:26188 ! polyketide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:48121 name: polyene is_a: CHEBI:33641 ! olefin [Term] id: CHEBI:48122 name: hydrogensilicate(3-) is_a: CHEBI:48123 ! silicate ion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:48123 name: silicate ion is_a: CHEBI:37191 ! silicon oxoanion [Term] id: CHEBI:48124 name: dihydrogensilicate(2-) is_a: CHEBI:48123 ! silicate ion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:48125 name: trihydrogensilicate(1-) is_a: CHEBI:48123 ! silicate ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:48129 name: benzoisochromanequinone is_a: CHEBI:25807 ! organooxygen heterocyclic antibiotic is_a: CHEBI:26188 ! polyketide is_a: CHEBI:36141 ! quinone [Term] id: CHEBI:48131 name: nonanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50177 ! dermatologic drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48132 name: tetracenomycin is_a: CHEBI:26188 ! polyketide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:48136 name: xanthosines is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:48144 name: cyclosiloxane is_a: CHEBI:26677 ! silicon molecular entity is_a: CHEBI:5686 ! heterocyclic compound [Term] id: CHEBI:48145 name: cyclotetrasiloxane subset: chebi_ph7_3 is_a: CHEBI:48144 ! cyclosiloxane [Term] id: CHEBI:48153 name: D-erythrose 4-phosphate is_a: CHEBI:23956 ! erythrose phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:48154 name: sulfur oxide is_a: CHEBI:24836 ! inorganic oxide is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:48206 name: fucopyranose is_a: CHEBI:33984 ! fucose [Term] id: CHEBI:48210 name: cyclopentafurofurochromene is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:48218 name: antiseptic drug is_a: CHEBI:35441 ! antiinfective agent [Term] id: CHEBI:48219 name: disinfectant is_a: CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:48230 name: diphthine residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:48249 name: 1r,3c,4t-p-menthane-3,8-diol is_a: CHEBI:48250 ! p-menthane-3,8-diol [Term] id: CHEBI:48250 name: p-menthane-3,8-diol subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid [Term] id: CHEBI:48251 name: 1alpha,3alpha,4beta-p-menthane-3,8-diol subset: chebi_ph7_3 is_a: CHEBI:48249 ! 1r,3c,4t-p-menthane-3,8-diol [Term] id: CHEBI:48262 name: D-erythrulose 1-phosphate is_a: CHEBI:14216 ! erythrulose 1-phosphate [Term] id: CHEBI:48274 name: tryptamine alkaloid is_a: CHEBI:27162 ! tryptamines is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:48278 name: serotonergic drug is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:48279 name: serotonergic antagonist is_a: CHEBI:48278 ! serotonergic drug [Term] id: CHEBI:4828 name: ergothioneine is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:38161 ! chelator relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:48289 name: 2-O-sulfolactic acid is_a: CHEBI:38024 ! carboxyalkyl sulfate [Term] id: CHEBI:48290 name: (R)-2-O-sulfolactic acid is_a: CHEBI:48289 ! 2-O-sulfolactic acid [Term] id: CHEBI:48291 name: (R)-3-sulfolactic acid is_a: CHEBI:38023 ! 3-sulfolactic acid [Term] id: CHEBI:48299 name: butane-1,2,3,4-tetrol subset: chebi_ph7_3 is_a: CHEBI:33729 ! tetritol [Term] id: CHEBI:48300 name: D-threitol subset: chebi_ph7_3 is_a: CHEBI:26981 ! threitol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:48305 name: 2-aminobut-2-enoic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:48306 name: 2-aminobut-2-enoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:48307 name: L-apiitol subset: chebi_ph7_3 is_a: CHEBI:48310 ! apiitol [Term] id: CHEBI:48309 name: N-formyl-L-glutamic acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid is_a: CHEBI:50759 ! N-formyl amino acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:48310 name: apiitol subset: chebi_ph7_3 is_a: CHEBI:63435 ! tetritol derivative [Term] id: CHEBI:48313 name: triphosphate(1-) is_a: CHEBI:15266 ! triphosphate ion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:48314 name: triphosphate(2-) is_a: CHEBI:15266 ! triphosphate ion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:48315 name: triphosphate(3-) is_a: CHEBI:15266 ! triphosphate ion [Term] id: CHEBI:48316 name: triphosphate(4-) is_a: CHEBI:15266 ! triphosphate ion [Term] id: CHEBI:48318 name: fragrance is_a: CHEBI:33232 ! application [Term] id: CHEBI:48337 name: pyrrolopyrazine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:48343 name: disulfide is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:48345 name: pyrazinecarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:38314 ! pyrazines [Term] id: CHEBI:48353 name: serine proteinase inhibitor is_a: CHEBI:37670 ! protease inhibitor is_a: CHEBI:5924 ! EC 3.4.21.* (serine endopeptidase) inhibitor [Term] id: CHEBI:48354 name: polar solvent is_a: CHEBI:46787 ! solvent [Term] id: CHEBI:48355 name: non-polar solvent is_a: CHEBI:46787 ! solvent [Term] id: CHEBI:48356 name: protic solvent is_a: CHEBI:39141 ! Bronsted acid is_a: CHEBI:48354 ! polar solvent [Term] id: CHEBI:48357 name: aprotic solvent is_a: CHEBI:46787 ! solvent [Term] id: CHEBI:48358 name: polar aprotic solvent is_a: CHEBI:48354 ! polar solvent is_a: CHEBI:48357 ! aprotic solvent [Term] id: CHEBI:48359 name: protophilic solvent is_a: CHEBI:39142 ! Bronsted base is_a: CHEBI:48354 ! polar solvent [Term] id: CHEBI:48360 name: amphiprotic solvent is_a: CHEBI:48356 ! protic solvent is_a: CHEBI:48359 ! protophilic solvent [Term] id: CHEBI:48361 name: butene is_a: CHEBI:138675 ! gas molecular entity is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:48362 name: but-1-ene subset: chebi_ph7_3 is_a: CHEBI:48361 ! butene [Term] id: CHEBI:48376 name: carbamimidic acid is_a: CHEBI:48379 ! isourea is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:48377 name: imidic acid is_a: CHEBI:33241 ! oxoacid derivative is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:48378 name: carboximidic acid is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:48377 ! imidic acid [Term] id: CHEBI:48379 name: isourea is_a: CHEBI:48378 ! carboximidic acid [Term] id: CHEBI:48396 name: 7(1)-hydroxychlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:48398 name: pyropheophorbide a is_a: CHEBI:38254 ! pheophorbide [Term] id: CHEBI:48399 name: 13(2)-carboxypyropheophorbide a is_a: CHEBI:38254 ! pheophorbide [Term] id: CHEBI:48400 name: 3-(3,4-dihydroxyphenyl)propanoic acid is_a: CHEBI:149591 ! (dihydroxyphenyl)propanoic acid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:48402 name: UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-glucuronic acid is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:48403 name: UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-mannuronic acid is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:48404 name: UDP-alpha-D-mannuronic acid is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:48405 name: 1D-myo-inositol 1,2,3,5,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate [Term] id: CHEBI:48407 name: antiparkinson drug is_a: CHEBI:66956 ! antidyskinesia agent [Term] id: CHEBI:48420 name: biphenylyltetrazole is_a: CHEBI:22888 ! biphenyls is_a: CHEBI:35689 ! tetrazoles [Term] id: CHEBI:48422 name: angiogenesis inhibitor is_a: CHEBI:23888 ! drug [Term] id: CHEBI:48423 name: 3-hydroxy-L-aspartic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83978 ! L-aspartic acid derivative is_a: CHEBI:83981 ! 3-hydroxyaspartic acid [Term] id: CHEBI:48427 name: N-formimidoyl-L-aspartic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid is_a: CHEBI:83978 ! L-aspartic acid derivative relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:48429 name: N-formyl-L-aspartic acid is_a: CHEBI:21647 ! N-acyl-L-aspartic acid is_a: CHEBI:50759 ! N-formyl amino acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:48430 name: 4-methyl-2-oxopentanoic acid is_a: CHEBI:191197 ! branched-chain keto acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:48431 name: formimidic acid is_a: CHEBI:48378 ! carboximidic acid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:48432 name: angiotensin II is_a: CHEBI:48433 ! angiotensin relationship: has_role CHEBI:50514 ! vasoconstrictor agent [Term] id: CHEBI:48433 name: angiotensin is_a: CHEBI:25905 ! peptide hormone [Term] id: CHEBI:48436 name: thiophenecarboxylic acid is_a: CHEBI:26961 ! thiophenes is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:48455 name: 2-demethylmenaquinone-8 subset: chebi_ph7_3 is_a: CHEBI:28192 ! 2-demethylmenaquinone [Term] id: CHEBI:48462 name: 5-deoxy-alpha-D-ribose 1-phosphate is_a: CHEBI:20568 ! 5-deoxyribose phosphate [Term] id: CHEBI:48467 name: (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid is_a: CHEBI:16577 ! 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid [Term] id: CHEBI:48470 name: amidobenzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:48474 name: (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:15494 ! 3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA [Term] id: CHEBI:48513 name: carbazoles is_a: CHEBI:39205 ! dibenzopyrrole [Term] id: CHEBI:48517 name: 7H-xanthine subset: chebi_ph7_3 is_a: CHEBI:15318 ! xanthine [Term] id: CHEBI:48526 name: hydratropic acid is_a: CHEBI:16333 ! 2-arylpropionic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:48527 name: (S)-hydratropic acid is_a: CHEBI:48526 ! hydratropic acid [Term] id: CHEBI:48529 is_obsolete: true replaced_by: CHEBI:28956 [Term] id: CHEBI:48536 name: amidopyrimidine is_a: CHEBI:39447 ! pyrimidines is_a: CHEBI:62733 ! aromatic amide [Term] id: CHEBI:48539 name: alpha-adrenergic drug is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:48540 name: beta-adrenergic drug is_a: CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:48542 name: deca-2,4,6,8-tetraenedioic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid [Term] id: CHEBI:48544 name: methanesulfonates is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:48545 name: pentapeptide is_a: CHEBI:25676 ! oligopeptide [Term] id: CHEBI:48550 name: EC 1.1.1.21 (aldehyde reductase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:48551 name: guanidino group is_a: CHEBI:33456 ! organoheteryl group [Term] id: CHEBI:48560 name: dopaminergic agent is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:48561 name: dopaminergic antagonist is_a: CHEBI:48560 ! dopaminergic agent is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:48563 name: methylsulfanyl group subset: chebi_ph7_3 is_a: CHEBI:33456 ! organoheteryl group [Term] id: CHEBI:48578 name: radical scavenger is_a: CHEBI:22586 ! antioxidant [Term] id: CHEBI:48582 name: ADP-alpha-D-ribose 1'',2''-cyclic phosphate is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:48584 name: ADP-alpha-D-ribose 1''-phosphate is_a: CHEBI:191408 ! ADP-alpha-D-ribose is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:48585 name: heteroarylpiperidine is_a: CHEBI:26151 ! piperidines [Term] id: CHEBI:48589 name: piperidones is_a: CHEBI:26151 ! piperidines is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:48590 name: hydroxypiperidine is_a: CHEBI:26151 ! piperidines [Term] id: CHEBI:48591 name: N-acylpiperidine is_a: CHEBI:26151 ! piperidines is_a: CHEBI:32988 ! amide [Term] id: CHEBI:48592 name: piperidinecarboxamide is_a: CHEBI:26151 ! piperidines is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:48595 name: 5'-S-methyl-5'-thioinosine subset: chebi_ph7_3 is_a: CHEBI:24844 ! inosines is_a: CHEBI:36988 ! 5'-deoxyribonucleoside [Term] id: CHEBI:48597 name: arsenate(2-) subset: chebi_ph7_3 is_a: CHEBI:22629 ! arsenate ion [Term] id: CHEBI:48600 name: arsenate(1-) is_a: CHEBI:22629 ! arsenate ion [Term] id: CHEBI:48604 name: carnitinamide subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_part CHEBI:23004 ! carbamoyl group relationship: has_part CHEBI:43176 ! hydroxy group [Term] id: CHEBI:48621 name: Sep-tRNA(Sec) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA [Term] id: CHEBI:48622 name: pGpG is_a: CHEBI:48638 ! 5'-phospho-(3'->5')-dinucleotide [Term] id: CHEBI:48626 name: pyranoindolizinoquinoline is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:48635 name: fumagillin is_a: CHEBI:133131 ! spiro-epoxide is_a: CHEBI:25807 ! organooxygen heterocyclic antibiotic is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:64419 ! meroterpenoid is_a: CHEBI:87113 ! antibiotic antifungal drug relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:73361 ! methionine aminopeptidase 2 inhibitor relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:48637 name: (3'->5')-dinucleotide is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:48638 name: 5'-phospho-(3'->5')-dinucleotide is_a: CHEBI:48637 ! (3'->5')-dinucleotide [Term] id: CHEBI:48643 name: (2Z)-2-hydroxypenta-2,4-dienoic acid is_a: CHEBI:18355 ! 2-hydroxypenta-2,4-dienoic acid [Term] id: CHEBI:48649 name: L-sorbopyranose subset: chebi_ph7_3 is_a: CHEBI:17266 ! L-sorbose is_a: CHEBI:48679 ! sorbopyranose [Term] id: CHEBI:48652 name: 1,3-thiazolemonocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38418 ! 1,3-thiazoles [Term] id: CHEBI:48657 name: L-xylo-hexos-2-ulose subset: chebi_ph7_3 is_a: CHEBI:48664 ! xylo-hexos-2-ulose [Term] id: CHEBI:4866 name: 17beta-estradiol 3-sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:48664 name: xylo-hexos-2-ulose is_a: CHEBI:33921 ! ketoaldohexose [Term] id: CHEBI:48666 name: D-xylo-hexos-2-ulose subset: chebi_ph7_3 is_a: CHEBI:48664 ! xylo-hexos-2-ulose [Term] id: CHEBI:48675 name: antifibrinolytic drug is_a: CHEBI:48676 ! fibrin modulating drug [Term] id: CHEBI:48676 name: fibrin modulating drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:48679 name: sorbopyranose is_a: CHEBI:27922 ! sorbose [Term] id: CHEBI:48681 name: 2,3-dihydroxycinnamic acid is_a: CHEBI:24689 ! hydroxycinnamic acid [Term] id: CHEBI:48683 name: piperazinecarboxylic acid is_a: CHEBI:26144 ! piperazines is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:48691 name: 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)propanoic acid is_a: CHEBI:23469 ! cyclohexadienediol is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:48701 name: 7alpha,24-dihydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:48887 ! bile acid metabolite [Term] id: CHEBI:48705 name: agonist is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:48706 name: antagonist is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:48716 name: 9,9'-di-cis-zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:27362 ! zeta-carotene [Term] id: CHEBI:48717 name: 9,9',15-tri-cis-zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:27362 ! zeta-carotene [Term] id: CHEBI:48726 name: nitroanisoles is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:48741 name: beta-phellandrene subset: chebi_ph7_3 is_a: CHEBI:50034 ! phellandrene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48742 name: 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid relationship: has_role CHEBI:48887 ! bile acid metabolite [Term] id: CHEBI:48765 name: dimethylarsinic acid is_a: CHEBI:33406 ! organoarsenic compound relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:48775 name: cadmium(2+) subset: chebi_ph7_3 is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation is_a: CHEBI:63063 ! cadmium cation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:487869 name: clavulanate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:48796 name: iron-sulfur-molybdenum cluster subset: chebi_ph7_3 is_a: CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:488 name: 1,2-campholide subset: chebi_ph7_3 is_a: CHEBI:18946 ! delta-lactone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48819 name: cyano group subset: chebi_ph7_3 is_a: CHEBI:36823 ! pseudohalo group [Term] id: CHEBI:48828 name: cobalt(2+) subset: chebi_ph7_3 is_a: CHEBI:23336 ! cobalt cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:48847 name: heterocyclic fatty acid is_a: CHEBI:5686 ! heterocyclic compound is_a: CHEBI:59238 ! cyclic fatty acid [Term] id: CHEBI:48848 name: erythronolide A subset: chebi_ph7_3 is_a: CHEBI:23955 ! erythronolide [Term] id: CHEBI:4885 name: ethionamide subset: chebi_ph7_3 is_a: CHEBI:26421 ! pyridines is_a: CHEBI:47956 ! thiocarboxamide relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:35816 ! leprostatic drug relationship: has_role CHEBI:50185 ! fatty acid synthesis inhibitor relationship: has_role CHEBI:50266 ! prodrug [Term] id: CHEBI:48850 name: alkyloxynaphthalene is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:48851 name: methoxynaphthalene is_a: CHEBI:48850 ! alkyloxynaphthalene [Term] id: CHEBI:48854 name: sulfurous acid is_a: CHEBI:33402 ! sulfur oxoacid [Term] id: CHEBI:48861 name: 2-trans,6-trans,10-trans-geranylgeranyl diphosphate is_a: CHEBI:15831 ! geranylgeranyl diphosphate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:48863 name: phycocyanobilin is_a: CHEBI:22869 ! bilins relationship: has_role CHEBI:82632 ! phytochrome chromophore [Term] id: CHEBI:48867 name: 4-(trimethylammonio)but-2-enoic acid is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:48868 name: sn-1-O-(geranylgeranyl)glycerol 3-phosphate is_a: CHEBI:48869 ! 3-O-(geranylgeranyl)glycerol 1-phosphate [Term] id: CHEBI:48869 name: 3-O-(geranylgeranyl)glycerol 1-phosphate is_a: CHEBI:24232 ! geranylgeranylglycerol 1-phosphate [Term] id: CHEBI:48870 name: idaric acid anion is_a: CHEBI:24576 ! hexaric acid anion [Term] id: CHEBI:48871 name: galactaric acid anion is_a: CHEBI:24576 ! hexaric acid anion [Term] id: CHEBI:48873 name: cholinergic antagonist is_a: CHEBI:38323 ! cholinergic drug [Term] id: CHEBI:48876 name: muscarinic antagonist is_a: CHEBI:48873 ! cholinergic antagonist [Term] id: CHEBI:48878 name: nicotinic antagonist is_a: CHEBI:48873 ! cholinergic antagonist [Term] id: CHEBI:48882 name: (R)-atropine is_a: CHEBI:78734 ! tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate [Term] id: CHEBI:48887 name: bile acid metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:48891 name: thiazolidinone is_a: CHEBI:35622 ! thiazolidines [Term] id: CHEBI:48901 name: thiazoles is_a: CHEBI:38106 ! organosulfur heterocyclic compound is_a: CHEBI:68452 ! azole [Term] id: CHEBI:48905 name: (9Z,11E,13S,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:48907 name: (9Z,11E,15Z)-octadeca-9,11,15-trienoic acid is_a: CHEBI:38387 ! 9,11,15-octadecatrienoic acid [Term] id: CHEBI:48914 name: glucaric acid anion is_a: CHEBI:24576 ! hexaric acid anion [Term] id: CHEBI:48916 name: altraric acid anion is_a: CHEBI:24576 ! hexaric acid anion [Term] id: CHEBI:48923 name: erythromycin is_a: CHEBI:23953 ! erythromycins relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:48926 name: S-(hydroxymethyl)glutathione is_a: CHEBI:17021 ! S-substituted glutathione relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:48927 name: N-acyl-L-alpha-amino acid is_a: CHEBI:21644 ! N-acyl-L-amino acid [Term] id: CHEBI:48928 name: 6-phospho-D-gluconic acid is_a: CHEBI:35184 ! gluconic acid phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:48929 name: 3-carboxy-2,3-dihydroxypropanoate is_a: CHEBI:132950 ! tartrate relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:48930 name: (2R,3S)-3-carboxy-2,3-dihydroxypropanoate is_a: CHEBI:35400 ! meso-tartrate(1-) [Term] id: CHEBI:48931 name: (2S,3R)-3-carboxy-2,3-dihydroxypropanoate is_a: CHEBI:35400 ! meso-tartrate(1-) [Term] id: CHEBI:48932 name: L-glyceraldehyde 3-phosphate is_a: CHEBI:17138 ! glyceraldehyde 3-phosphate [Term] id: CHEBI:48937 name: phytane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:48939 name: (25R)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol subset: chebi_ph7_3 is_a: CHEBI:17278 ! 5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol [Term] id: CHEBI:48940 name: (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al subset: chebi_ph7_3 is_a: CHEBI:16466 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al [Term] id: CHEBI:48942 name: isovalerate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:83972 ! 3-methyl fatty acid anion relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48943 name: isobutyraldehyde subset: chebi_ph7_3 is_a: CHEBI:26282 ! propanals is_a: CHEBI:49188 ! 2-methyl-branched fatty aldehyde relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:48944 name: isobutyrate subset: chebi_ph7_3 is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:78115 ! fatty acid anion 4:0 relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:48946 name: 2-methylbutyrate subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion [Term] id: CHEBI:48947 name: clavulanic acid is_a: CHEBI:64509 ! oxapenam relationship: has_role CHEBI:35474 ! anxiolytic drug relationship: has_role CHEBI:35625 ! EC 3.5.2.6 (beta-lactamase) inhibitor relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:48948 name: demethylsulochrin is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:48949 name: 3-phenylcyclohexa-3,5-diene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:23469 ! cyclohexadienediol [Term] id: CHEBI:48950 name: L-2,4-diaminobutyric acid is_a: CHEBI:64307 ! 2,4-diaminobutyric acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:48951 name: cyclohexenone is_a: CHEBI:48953 ! cyclohexenones [Term] id: CHEBI:48953 name: cyclohexenones is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:48954 name: 7,8-dihydroneopterin 3'-phosphate is_a: CHEBI:25500 ! neopterins is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:48956 name: 5-O-phosphono-D-ribofuranosyl diphosphate is_a: CHEBI:12164 ! 5-phosphoribosyl diphosphate [Term] id: CHEBI:48957 name: N(2)-succinyl-L-glutamic acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:48958 name: 1,1'-azobis(N,N-dimethylformamide) subset: chebi_ph7_3 is_a: CHEBI:48959 ! monoazo compound [Term] id: CHEBI:48959 name: monoazo compound is_a: CHEBI:37533 ! azo compound [Term] id: CHEBI:48965 name: trans-chalcone subset: chebi_ph7_3 is_a: CHEBI:27618 ! chalcone relationship: has_role CHEBI:50627 ! EC 3.2.1.1 (alpha-amylase) inhibitor [Term] id: CHEBI:48968 name: (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoic acid is_a: CHEBI:15941 ! 2,3-dihydroxy-2,3-dihydrobenzoic acid [Term] id: CHEBI:48969 name: (2R,3R)-2,3-dihydroxy-2,3-dihydrobenzoic acid is_a: CHEBI:15941 ! 2,3-dihydroxy-2,3-dihydrobenzoic acid [Term] id: CHEBI:48975 name: substituted aniline is_a: CHEBI:22562 ! anilines [Term] id: CHEBI:48980 name: quinolin-7-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48981 name: quinolin-8-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:48218 ! antiseptic drug relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:48982 name: methylquinoline is_a: CHEBI:26513 ! quinolines [Term] id: CHEBI:48983 name: 4-methylquinoline subset: chebi_ph7_3 is_a: CHEBI:48982 ! methylquinoline relationship: has_role CHEBI:25435 ! mutagen [Term] id: CHEBI:48984 name: 8-methylquinoline subset: chebi_ph7_3 is_a: CHEBI:48982 ! methylquinoline [Term] id: CHEBI:48985 name: 8-chloroquinoline subset: chebi_ph7_3 is_a: CHEBI:26513 ! quinolines is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:48986 name: 4-methylquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:48987 name: 7-hydroxyquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48988 name: 8-hydroxyquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48989 name: 8-methylquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone [Term] id: CHEBI:48990 name: 8-chloroquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:48991 name: 7-methylxanthine subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:26385 ! purine alkaloid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:48993 name: quinolin-5-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48994 name: quinolin-6-ol subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48995 name: 5-hydroxyquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48996 name: 6-hydroxyquinolin-2(1H)-one subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:38775 ! monohydroxyquinoline [Term] id: CHEBI:48999 name: 4-hydroxyphenylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49002 name: N-acetyl-L-citrulline is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:49006 ! N-acetylcitrulline [Term] id: CHEBI:49003 name: 4-phospho-D-erythronic acid is_a: CHEBI:49055 ! 4-phosphoerythronic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:49004 name: N-acetyl-LL-2,6-diaminopimelic acid is_a: CHEBI:36164 ! amino dicarboxylic acid [Term] id: CHEBI:49006 name: N-acetylcitrulline is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:49007 name: D-citrulline is_a: CHEBI:18211 ! citrulline [Term] id: CHEBI:49008 name: (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid is_a: CHEBI:17095 ! cis-1,6-dihydroxy-4-methylcyclohexa-2,4-dienecarboxylic acid [Term] id: CHEBI:49009 name: (1S,6R)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid is_a: CHEBI:17095 ! cis-1,6-dihydroxy-4-methylcyclohexa-2,4-dienecarboxylic acid [Term] id: CHEBI:490095 name: esculetin subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:73335 ! ultraviolet filter relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49014 name: (S)-1-piperideine-6-carboxylic acid is_a: CHEBI:49015 ! 1-piperideine-6-carboxylic acid [Term] id: CHEBI:49015 name: 1-piperideine-6-carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26921 ! tetrahydropyridine relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:49016 name: 3-(methylthio)propionate subset: chebi_ph7_3 is_a: CHEBI:59848 ! thia fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49017 name: 3-methylthiopropanal subset: chebi_ph7_3 is_a: CHEBI:22327 ! aliphatic sulfide relationship: has_role CHEBI:49023 ! prostaglandin antagonist [Term] id: CHEBI:49018 name: neuraminic acid is_a: CHEBI:25508 ! neuraminic acids [Term] id: CHEBI:49019 name: 3-methylthiopropanol subset: chebi_ph7_3 is_a: CHEBI:22327 ! aliphatic sulfide is_a: CHEBI:86315 ! methyl sulfide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:49020 name: hormone antagonist is_a: CHEBI:48706 ! antagonist is_a: CHEBI:51061 ! hormone receptor modulator [Term] id: CHEBI:49022 name: beta-neuraminic acid is_a: CHEBI:7539 ! 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid [Term] id: CHEBI:49023 name: prostaglandin antagonist is_a: CHEBI:49020 ! hormone antagonist [Term] id: CHEBI:49024 name: alpha-neuraminic acid is_a: CHEBI:7539 ! 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid [Term] id: CHEBI:49026 name: N-acetyl-alpha-neuraminic acid is_a: CHEBI:17012 ! N-acetylneuraminic acid relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:49028 name: acetimidic acid is_a: CHEBI:48378 ! carboximidic acid [Term] id: CHEBI:49030 name: (R)-2-(carboxymethyl)-5-oxo-2,5-dihydro-2-furoic acid is_a: CHEBI:16993 ! 2-(carboxymethyl)-5-oxo-2,5-dihydro-2-furoic acid [Term] id: CHEBI:49031 name: L-methionine (S)-S-oxide is_a: CHEBI:17016 ! L-methionine S-oxide [Term] id: CHEBI:49032 name: L-methionine (R)-S-oxide is_a: CHEBI:17016 ! L-methionine S-oxide relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:49033 name: methionine S-oxide is_a: CHEBI:25230 ! methionine derivative relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49034 name: D-methionine S-oxide is_a: CHEBI:49033 ! methionine S-oxide [Term] id: CHEBI:49035 name: D-methionine (R)-S-oxide is_a: CHEBI:49034 ! D-methionine S-oxide [Term] id: CHEBI:49036 name: D-methionine (S)-S-oxide is_a: CHEBI:49034 ! D-methionine S-oxide [Term] id: CHEBI:49038 name: L-methionyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue is_a: CHEBI:37902 ! methionyl group [Term] id: CHEBI:49039 name: 3-dehydro-L-gulonic acid 6-phosphate is_a: CHEBI:63394 ! ketoaldonic acid derivative relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:49043 name: beta-lactone is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:49044 name: (-)-germacrene D subset: chebi_ph7_3 is_a: CHEBI:49045 ! germacrene D [Term] id: CHEBI:49045 name: germacrene D subset: chebi_ph7_3 is_a: CHEBI:36743 ! germacrene [Term] id: CHEBI:49046 name: (+)-germacrene D subset: chebi_ph7_3 is_a: CHEBI:49045 ! germacrene D [Term] id: CHEBI:49049 name: 3-oxo-3-ureidopropanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:49050 name: ureidoglycolic acid is_a: CHEBI:49052 ! ureidocarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:49051 name: 5,7-dihydro-1H-purine-2,6,8(9H)-trione subset: chebi_ph7_3 is_a: CHEBI:27226 ! uric acid [Term] id: CHEBI:49052 name: ureidocarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:49055 name: 4-phosphoerythronic acid is_a: CHEBI:37653 ! phosphoerythronic acid [Term] id: CHEBI:49056 name: 4-phospho-L-erythronic acid is_a: CHEBI:49055 ! 4-phosphoerythronic acid [Term] id: CHEBI:49057 name: (all-E)-deca-2,4,6,8-tetraenedioic acid is_a: CHEBI:48542 ! deca-2,4,6,8-tetraenedioic acid [Term] id: CHEBI:49058 name: L-erythronic acid is_a: CHEBI:37654 ! erythronic acid [Term] id: CHEBI:49059 name: D-threonic acid is_a: CHEBI:26984 ! threonic acid [Term] id: CHEBI:49060 name: 2,3,4-trihydroxybutanoic acid is_a: CHEBI:24684 ! hydroxybutyric acid is_a: CHEBI:33755 ! tetronic acid [Term] id: CHEBI:49061 name: 2,3,4-trihydroxybutanoate is_a: CHEBI:33762 ! tetronate [Term] id: CHEBI:49062 name: tetronic acid phosphate is_a: CHEBI:22300 ! aldonic acid phosphate [Term] id: CHEBI:49064 name: 4-phosphothreonic acid is_a: CHEBI:49065 ! phosphothreonic acid [Term] id: CHEBI:49065 name: phosphothreonic acid is_a: CHEBI:49062 ! tetronic acid phosphate [Term] id: CHEBI:49069 name: 4-phospho-D-threonic acid is_a: CHEBI:49064 ! 4-phosphothreonic acid [Term] id: CHEBI:49070 name: 3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid is_a: CHEBI:32328 ! 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)acrylic acid [Term] id: CHEBI:49071 name: 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid is_a: CHEBI:32328 ! 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)acrylic acid [Term] id: CHEBI:49072 name: (R)-2,3-dihydroxy-3-methylbutanoate subset: chebi_ph7_3 is_a: CHEBI:11424 ! 2,3-dihydroxy-3-methylbutanoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:49075 name: 2-formylglutaric acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:49076 name: (S)-2-hydroxymethylglutaric acid is_a: CHEBI:49077 ! 2-hydroxymethylglutaric acid [Term] id: CHEBI:49077 name: 2-hydroxymethylglutaric acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:49078 name: (R)-2-hydroxymethylglutaric acid is_a: CHEBI:49077 ! 2-hydroxymethylglutaric acid [Term] id: CHEBI:49080 name: marmesin subset: chebi_ph7_3 is_a: CHEBI:26369 ! psoralens is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:49081 name: 6-(2-amino-2-carboxyethyl)-7,8-dioxo-1,2,3,4,7,8-hexahydroquinoline-2,4-dicarboxylic acid is_a: CHEBI:25622 ! orthoquinones is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:27171 ! organic heterobicyclic compound [Term] id: CHEBI:49084 name: N-acyl-D-glutamates(1-) is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:49085 name: N-acyl-D-glutamic acid is_a: CHEBI:15778 ! N-acyl-D-amino acid is_a: CHEBI:21658 ! N-acylglutamic acid is_a: CHEBI:83983 ! D-glutamic acid derivative [Term] id: CHEBI:49086 name: CDP-choline(1+) is_a: CHEBI:25604 ! nucleotide-(amino alcohol)s [Term] id: CHEBI:49087 name: 2,6-dihydroxynicotinic acid is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:49088 name: D-tagatofuranose subset: chebi_ph7_3 is_a: CHEBI:16443 ! D-tagatose [Term] id: CHEBI:49094 name: tagatose 6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49095 name: beta-amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:49096 name: 3-aminoisobutyrate is_a: CHEBI:49095 ! beta-amino-acid anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:49097 name: (R)-3-aminoisobutyrate is_a: CHEBI:49096 ! 3-aminoisobutyrate [Term] id: CHEBI:49098 name: (6R)-2-acetyl-6-(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)-3-hydroxy-6-methylcyclohexa-2,4-dien-1-one is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:49100 name: adenosylcobalamin 5'-phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:49101 name: N-(3,4-dichlorophenyl)malonamic acid is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:49102 name: malonamate subset: chebi_ph7_3 is_a: CHEBI:49095 ! beta-amino-acid anion [Term] id: CHEBI:49103 name: drug metabolite is_a: CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:49104 name: heteroarenecarbaldehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:49106 name: oxepane subset: chebi_ph7_3 is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:37407 ! cyclic ether [Term] id: CHEBI:49107 name: thiamine(2+) is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:49108 name: dopachrome is_a: CHEBI:25622 ! orthoquinones [Term] id: CHEBI:49109 name: D-dopachrome is_a: CHEBI:49108 ! dopachrome [Term] id: CHEBI:4911 name: etoposide subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50307 ! furonaphthodioxole relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor [Term] id: CHEBI:49110 name: peripheral nervous system drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:49124 name: N-(beta-D-glucosyl)nicotinic acid is_a: CHEBI:7285 ! N-(D-glucopyranosyl)nicotinic acid [Term] id: CHEBI:49125 name: N-(beta-D-glucosyl)nicotinate subset: chebi_ph7_3 is_a: CHEBI:15917 ! N-(D-glucopyranosyl)nicotinate [Term] id: CHEBI:49156 name: (6S)-vomifoliol subset: chebi_ph7_3 is_a: CHEBI:28258 ! vomifoliol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:49160 name: (6R,9S)-vomifoliol subset: chebi_ph7_3 is_a: CHEBI:49161 ! (6R)-vomifoliol [Term] id: CHEBI:49161 name: (6R)-vomifoliol subset: chebi_ph7_3 is_a: CHEBI:28258 ! vomifoliol [Term] id: CHEBI:49164 name: (6S,9R)-vomifoliol subset: chebi_ph7_3 is_a: CHEBI:49156 ! (6S)-vomifoliol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:38231 ! phytotoxin [Term] id: CHEBI:49167 name: anti-asthmatic drug is_a: CHEBI:23888 ! drug is_a: CHEBI:65023 ! anti-asthmatic agent [Term] id: CHEBI:49168 name: dopa is_a: CHEBI:24734 ! hydroxyphenylalanine is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49169 name: D-dopa is_a: CHEBI:49168 ! dopa is_a: CHEBI:84124 ! D-tyrosine derivative [Term] id: CHEBI:4917 name: eugenol subset: chebi_ph7_3 is_a: CHEBI:195237 ! alkenylbenzene is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:139492 ! sensitiser relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:38623 ! EC 1.4.3.4 (monoamine oxidase) inhibitor relationship: has_role CHEBI:38634 ! voltage-gated sodium channel blocker relationship: has_role CHEBI:38867 ! anaesthetic relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:49172 name: 1,2-diglyceride subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:49173 name: 2-hydroxy-3-methylacyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:49174 name: 2-hydroxy-3-methylhexadecanoyl-CoA is_a: CHEBI:49173 ! 2-hydroxy-3-methylacyl-CoA [Term] id: CHEBI:49175 name: 2-hydroxy-3-methylhexadecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid [Term] id: CHEBI:49177 name: (6R)-dehydrovomifoliol subset: chebi_ph7_3 is_a: CHEBI:18429 ! dehydrovomifoliol [Term] id: CHEBI:49178 name: 2,3-dihydroxy-2,3-dihydrobenzoyl-CoA is_a: CHEBI:61940 ! aroyl-CoA [Term] id: CHEBI:49179 name: cis-3,4-didehydroadipoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27773 ! cis-3-enoyl-CoA [Term] id: CHEBI:49180 name: cis-3,4-didehydroadipoyl-CoA semialdehyde is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27773 ! cis-3-enoyl-CoA [Term] id: CHEBI:49181 name: (R)-1,2-didecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:11152 ! 1,2-didecanoylglycerol [Term] id: CHEBI:49182 name: 1,5-anhydro-D-mannitol subset: chebi_ph7_3 is_a: CHEBI:22558 ! anhydro sugar [Term] id: CHEBI:49183 name: phosphatidylcholine(1+) is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:49187 name: (-)-abscisic aldehyde subset: chebi_ph7_3 is_a: CHEBI:22144 ! abscisic aldehyde [Term] id: CHEBI:49188 name: 2-methyl-branched fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:49189 name: pristanal subset: chebi_ph7_3 is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:49188 ! 2-methyl-branched fatty aldehyde relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49190 name: 2-methylpentadecanal subset: chebi_ph7_3 is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:49188 ! 2-methyl-branched fatty aldehyde [Term] id: CHEBI:49191 name: momilactone A subset: chebi_ph7_3 is_a: CHEBI:49192 ! pimarane diterpenoid is_a: CHEBI:49193 ! diterpene lactone [Term] id: CHEBI:49192 name: pimarane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:49193 name: diterpene lactone is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:37668 ! terpene lactone [Term] id: CHEBI:49194 name: 3-(1-carboxyvinyloxy)anthranilic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:49195 name: 3beta-hydroxy-9beta-pimara-7,15-dien-19,6beta-olide subset: chebi_ph7_3 is_a: CHEBI:49192 ! pimarane diterpenoid is_a: CHEBI:49193 ! diterpene lactone [Term] id: CHEBI:49197 name: 2-amino-2-deoxyisochorismic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:49198 name: 2-O-sinapoyl-D-glucaric acid is_a: CHEBI:46638 ! O-sinapoyl-D-glucaric acid [Term] id: CHEBI:49201 name: anti-ulcer drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:49202 name: elemental platinum is_a: CHEBI:33749 ! platinum molecular entity [Term] id: CHEBI:49204 name: (+)-guaia-6,9-diene subset: chebi_ph7_3 is_a: CHEBI:49206 ! (1xi,4xi,5xi)-guaia-6,9-diene [Term] id: CHEBI:49206 name: (1xi,4xi,5xi)-guaia-6,9-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:49207 name: (-)-guaia-6,9-diene subset: chebi_ph7_3 is_a: CHEBI:49206 ! (1xi,4xi,5xi)-guaia-6,9-diene [Term] id: CHEBI:49209 name: himachalene is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49210 name: beta-himachalene subset: chebi_ph7_3 is_a: CHEBI:49209 ! himachalene [Term] id: CHEBI:49214 name: alpha-himachalene subset: chebi_ph7_3 is_a: CHEBI:49209 ! himachalene [Term] id: CHEBI:49222 name: (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoic acid is_a: CHEBI:49223 ! 4-(2-carboxyphenyl)-2-oxobut-3-enoic acid [Term] id: CHEBI:49223 name: 4-(2-carboxyphenyl)-2-oxobut-3-enoic acid is_a: CHEBI:25754 ! oxo carboxylic acid [Term] id: CHEBI:49224 name: gamma-himachalene subset: chebi_ph7_3 is_a: CHEBI:49209 ! himachalene [Term] id: CHEBI:49231 name: sibirene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:49235 name: bisabolene is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:49237 name: gamma-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49235 ! bisabolene [Term] id: CHEBI:49238 name: (Z)-gamma-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49237 ! gamma-bisabolene [Term] id: CHEBI:49239 name: (E)-gamma-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49237 ! gamma-bisabolene [Term] id: CHEBI:49240 name: alpha-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49235 ! bisabolene [Term] id: CHEBI:49242 name: (E)-alpha-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49240 ! alpha-bisabolene [Term] id: CHEBI:49243 name: (E,R)-alpha-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49242 ! (E)-alpha-bisabolene [Term] id: CHEBI:49244 name: (E,S)-alpha-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49242 ! (E)-alpha-bisabolene [Term] id: CHEBI:49247 name: apo carotenoid monoterpenoid is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:49248 name: ionone is_a: CHEBI:49247 ! apo carotenoid monoterpenoid relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49249 name: beta-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49235 ! bisabolene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49252 name: 1,2-dihydroxy-5-(methylthio)pent-1-en-3-one subset: chebi_ph7_3 is_a: CHEBI:22327 ! aliphatic sulfide is_a: CHEBI:51689 ! enone is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:49253 name: (9S,10S)-10-hydroxy-9-(phosphonooxy)octadecanoic acid is_a: CHEBI:36949 ! hydroxyalkyl phosphate is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:49254 name: (S,S)-9,10-dihydroxyoctadecanoic acid is_a: CHEBI:28724 ! 9,10-dihydroxyoctadecanoic acid [Term] id: CHEBI:49255 name: N-(6-aminohexanoyl)-6-aminohexanoic acid is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:49256 name: (S)-2-acetyl-2-hydroxybutanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:49257 name: (R)-3-hydroxy-3-methyl-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:53338 ! 3-hydroxy-3-methyl-2-oxopentanoate [Term] id: CHEBI:49258 name: (2R,3R)-2,3-dihydroxy-3-methylpentanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:49259 name: (2S)-2-[(R)-1-carboxyethylamino]pentanoic acid is_a: CHEBI:36164 ! amino dicarboxylic acid [Term] id: CHEBI:49260 name: 4-(L-gamma-glutamylamino)butanoic acid is_a: CHEBI:134018 ! N-acyl-gamma-aminobutyric acid is_a: CHEBI:36164 ! amino dicarboxylic acid relationship: has_part CHEBI:32474 ! L-gamma-glutamyl group relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:49261 name: 3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:49262 name: cyclohexa-1,5-diene-1-carboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:49263 name: (S)-beta-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49249 ! beta-bisabolene [Term] id: CHEBI:49264 name: nonatrienedicarboxylic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid [Term] id: CHEBI:49265 name: 8-[(1R,2R)-3-oxo-2-\{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid is_a: CHEBI:191853 ! 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid [Term] id: CHEBI:49266 name: (R)-beta-bisabolene subset: chebi_ph7_3 is_a: CHEBI:49249 ! beta-bisabolene [Term] id: CHEBI:49268 name: 5-amino-2-oxopentanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:35931 ! delta-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:49269 name: 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oic acid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:49270 name: 12alpha-hydroxy-3-oxochola-4,6-dien-24-oic acid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:49271 name: (5xi,7xi,10xi)-eudesma-4(14),11-diene subset: chebi_ph7_3 is_a: CHEBI:49272 ! selinene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49272 name: selinene is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49273 name: cholenoic acid is_a: CHEBI:36078 ! cholanoid is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:49274 name: (-)-beta-selinene subset: chebi_ph7_3 is_a: CHEBI:49276 ! beta-selinene [Term] id: CHEBI:49275 name: chol-4-en-24-oic acid is_a: CHEBI:49273 ! cholenoic acid [Term] id: CHEBI:49276 name: beta-selinene is_a: CHEBI:49271 ! (5xi,7xi,10xi)-eudesma-4(14),11-diene relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:49277 name: chola-4,6-dien-24-oic acid is_a: CHEBI:49273 ! cholenoic acid [Term] id: CHEBI:49278 name: delta-selinene subset: chebi_ph7_3 is_a: CHEBI:49272 ! selinene [Term] id: CHEBI:49279 name: (+)-delta-selinene subset: chebi_ph7_3 is_a: CHEBI:49278 ! delta-selinene [Term] id: CHEBI:49280 name: (-)-delta-selinene subset: chebi_ph7_3 is_a: CHEBI:49278 ! delta-selinene [Term] id: CHEBI:49283 name: 3-hexenoic acid is_a: CHEBI:24580 ! hexenoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49284 name: cis-hex-3-enoic acid is_a: CHEBI:49283 ! 3-hexenoic acid [Term] id: CHEBI:49285 name: trans-hex-3-enoic acid is_a: CHEBI:49283 ! 3-hexenoic acid [Term] id: CHEBI:49289 name: humulene is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:49290 name: gamma-humulene subset: chebi_ph7_3 is_a: CHEBI:49289 ! humulene [Term] id: CHEBI:49298 name: N-formyl-L-methionyl group subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:49299 name: D-fructofuranose 1,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:49301 name: hydrindane subset: chebi_ph7_3 is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon [Term] id: CHEBI:49302 name: 2-hydroxy monocarboxylic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:49305 name: 5,6alpha-epoxy-5alpha-cholestan-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:49310 name: 7-methylxanthosine subset: chebi_ph7_3 is_a: CHEBI:48136 ! xanthosines [Term] id: CHEBI:49311 name: alpha-humulene subset: chebi_ph7_3 is_a: CHEBI:49289 ! humulene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49314 name: germacrene B is_a: CHEBI:36743 ! germacrene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49318 name: piperidine antibiotic is_a: CHEBI:25558 ! organonitrogen heterocyclic antibiotic is_a: CHEBI:26151 ! piperidines [Term] id: CHEBI:49319 name: carbocyclic antibiotic is_a: CHEBI:33598 ! carbocyclic compound relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:49322 name: anthracycline antibiotic is_a: CHEBI:48120 ! anthracycline relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:49323 name: contraceptive drug is_a: CHEBI:50689 ! reproductive control drug [Term] id: CHEBI:4935 name: eupatolide subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:73011 ! germacranolide relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:49388 name: bacterioruberin subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33573 ! tetrol is_a: CHEBI:87165 ! C50 carotenoid relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:49432 name: 5-hydroxyectoine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35359 ! carboxamidine is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:78715 ! 1,4,5,6-tetrahydropyrimidines [Term] id: CHEBI:49468 name: silver(1+) subset: chebi_ph7_3 is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:33966 ! elemental silver is_a: CHEBI:60242 ! monovalent inorganic cation is_a: CHEBI:60253 ! silver cation [Term] id: CHEBI:49496 name: gold(3+) subset: chebi_ph7_3 is_a: CHEBI:27153 ! monoatomic trication is_a: CHEBI:33970 ! elemental gold [Term] id: CHEBI:49537 name: c-di-GMP is_a: CHEBI:47037 ! cyclic purine dinucleotide is_a: CHEBI:61295 ! guanyl ribonucleotide relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:49544 name: chromium(3+) subset: chebi_ph7_3 is_a: CHEBI:27153 ! monoatomic trication is_a: CHEBI:33516 ! chromium cation [Term] id: CHEBI:495505 name: dATP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:49552 name: copper(1+) subset: chebi_ph7_3 is_a: CHEBI:23378 ! copper cation is_a: CHEBI:25414 ! monoatomic monocation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:49575 name: diazepam subset: chebi_ph7_3 is_a: CHEBI:35500 ! 1,4-benzodiazepinone is_a: CHEBI:36683 ! organochlorine compound relationship: has_role CHEBI:35474 ! anxiolytic drug relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35717 ! sedative relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:49601 name: Fe2S2 iron-sulfur cluster is_a: CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:49603 name: lapatinib is_a: CHEBI:24129 ! furans is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:38530 ! quinazolines relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38637 ! tyrosine kinase inhibitor [Term] id: CHEBI:49637 name: hydrogen atom is_a: CHEBI:24835 ! inorganic molecular entity is_a: CHEBI:25585 ! nonmetal atom is_a: CHEBI:33559 ! s-block element atom relationship: has_role CHEBI:33937 ! macronutrient [Term] id: CHEBI:49643 name: (2R)-3-HYDROXY-2-METHYLPROPANOIC ACID is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:49709 name: chlorate subset: chebi_ph7_3 is_a: CHEBI:33437 ! chlorine oxoanion is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:49713 name: lithium(1+) subset: chebi_ph7_3 is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:33504 ! alkali metal cation is_a: CHEBI:60242 ! monovalent inorganic cation [Term] id: CHEBI:49747 name: methylmercury(1+) subset: chebi_ph7_3 is_a: CHEBI:25322 ! methylmercury compound [Term] id: CHEBI:49751 name: D-monapterin subset: chebi_ph7_3 is_a: CHEBI:25500 ! neopterins [Term] id: CHEBI:49770 name: methyl red is_a: CHEBI:22682 ! azobenzenes is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:37958 ! dye [Term] id: CHEBI:497734 name: L-thialysine is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:75190 ! EC 5.4.3.2 (lysine 2,3-aminomutase) inhibitor [Term] id: CHEBI:49786 name: nickel(2+) subset: chebi_ph7_3 is_a: CHEBI:25516 ! nickel cation is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation is_a: CHEBI:88186 ! metal cation allergen relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:49807 name: lead(2+) subset: chebi_ph7_3 is_a: CHEBI:30412 ! monoatomic dication is_a: CHEBI:60240 ! divalent metal cation is_a: CHEBI:60252 ! lead cation relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:4986 name: fatty acid methyl ester subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:49870 name: antimonous acid subset: chebi_ph7_3 is_a: CHEBI:36920 ! antimony oxoacid [Term] id: CHEBI:49883 name: tetra-mu3-sulfido-tetrairon subset: chebi_ph7_3 is_a: CHEBI:64607 ! Fe4S4 iron-sulfur cluster relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:49900 name: arsenous acid is_a: CHEBI:33407 ! arsenic oxoacid [Term] id: CHEBI:49983 name: 3-aminoalaninate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:4999 name: fenchone subset: chebi_ph7_3 is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:36739 ! fenchane monoterpenoid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50004 name: cis-stilbene oxide subset: chebi_ph7_3 is_a: CHEBI:50006 ! stilbene oxide [Term] id: CHEBI:50006 name: stilbene oxide subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide [Term] id: CHEBI:50007 name: antimony coordination entity is_a: CHEBI:36919 ! antimony molecular entity [Term] id: CHEBI:5001 name: fenofibrate subset: chebi_ph7_3 is_a: CHEBI:23135 ! chlorobenzophenone is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35725 ! isopropyl ester is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:50013 name: hydrobenzoin subset: chebi_ph7_3 is_a: CHEBI:23976 ! ethanediol [Term] id: CHEBI:50014 name: (R,R)-hydrobenzoin subset: chebi_ph7_3 is_a: CHEBI:50013 ! hydrobenzoin [Term] id: CHEBI:50017 name: arsonous acids is_a: CHEBI:33407 ! arsenic oxoacid [Term] id: CHEBI:50018 name: glycosyloxyflavone is_a: CHEBI:24043 ! flavones is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:50025 name: beta-pinene subset: chebi_ph7_3 is_a: CHEBI:17187 ! pinene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50026 name: (+)-beta-pinene subset: chebi_ph7_3 is_a: CHEBI:50025 ! beta-pinene [Term] id: CHEBI:50027 name: sabinene subset: chebi_ph7_3 is_a: CHEBI:50030 ! thujene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50028 name: (-)-sabinene subset: chebi_ph7_3 is_a: CHEBI:50027 ! sabinene [Term] id: CHEBI:50029 name: (+)-sabinene subset: chebi_ph7_3 is_a: CHEBI:50027 ! sabinene [Term] id: CHEBI:50030 name: thujene is_a: CHEBI:35187 ! monoterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:50034 name: phellandrene is_a: CHEBI:33643 ! cycloalkene is_a: CHEBI:50073 ! p-menthadiene [Term] id: CHEBI:50036 name: (6aS,11aS)-4-dimethylallyl-3,6a,9-trihydroxypterocarpan subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:50037 name: N-benzoylanthranilic acid is_a: CHEBI:48470 ! amidobenzoic acid [Term] id: CHEBI:50038 name: deoxyhypusine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50040 name: thujone subset: chebi_ph7_3 is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:50041 ! thujane monoterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50041 name: thujane monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:50042 name: alpha-thujone is_a: CHEBI:50040 ! thujone [Term] id: CHEBI:50043 name: (+)-alpha-thujone subset: chebi_ph7_3 is_a: CHEBI:50042 ! alpha-thujone [Term] id: CHEBI:50047 name: organic amino compound is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:50860 ! organic molecular entity relationship: has_role CHEBI:39142 ! Bronsted base [Term] id: CHEBI:50048 name: phenylethylamine is_a: CHEBI:32877 ! primary amine [Term] id: CHEBI:50051 name: cystine residue is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:50058 name: L-cystine residue subset: chebi_ph7_3 is_a: CHEBI:50051 ! cystine residue [Term] id: CHEBI:50059 name: imidazolium cation is_a: CHEBI:59964 ! imidazolium ion [Term] id: CHEBI:50060 name: ent-cassa-12,15-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50061 name: ent-sandaracopimara-8(14),15-diene subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene [Term] id: CHEBI:50062 name: pimaradiene is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50063 name: ent-pimara-8(14),15-diene subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene [Term] id: CHEBI:50064 name: ent-pimara-9(11),15-diene subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene [Term] id: CHEBI:50065 name: D-cystine residue is_a: CHEBI:50051 ! cystine residue [Term] id: CHEBI:50067 name: 9beta-pimara-7,15-diene subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene [Term] id: CHEBI:50068 name: stemod-13(17)-ene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50069 name: stemar-13-ene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50070 name: ascopyrone M subset: chebi_ph7_3 is_a: CHEBI:131907 ! 3-pyrones is_a: CHEBI:22557 ! anhydrohexose is_a: CHEBI:24965 ! deoxyketohexose [Term] id: CHEBI:50071 name: ascopyrone P subset: chebi_ph7_3 is_a: CHEBI:22557 ! anhydrohexose is_a: CHEBI:24965 ! deoxyketohexose [Term] id: CHEBI:50072 name: abietadiene is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50073 name: p-menthadiene is_a: CHEBI:35187 ! monoterpene [Term] id: CHEBI:50075 name: dihydropyridine is_a: CHEBI:26421 ! pyridines [Term] id: CHEBI:50091 name: S-nitrosoglutathione is_a: CHEBI:145545 ! nitrosothio compound is_a: CHEBI:24337 ! glutathione derivative relationship: has_role CHEBI:35523 ! bronchodilator agent relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:50566 ! nitric oxide donor relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:50103 name: excitatory amino acid agonist is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:50106 name: 5beta-scymnol subset: chebi_ph7_3 is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:37914 ! 27-hydroxy steroid [Term] id: CHEBI:50107 name: 5beta-scymnol sulfate is_a: CHEBI:16158 ! steroid sulfate [Term] id: CHEBI:50108 name: 5alpha-cholane-3alpha,7alpha,12alpha,24-tetrol subset: chebi_ph7_3 is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid [Term] id: CHEBI:50109 name: 3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-yl sulfate is_a: CHEBI:16158 ! steroid sulfate [Term] id: CHEBI:50110 name: isopiperitenone subset: chebi_ph7_3 is_a: CHEBI:26153 ! p-menthadien-3-one [Term] id: CHEBI:50111 name: deoxycholoyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:50112 name: sex hormone is_a: CHEBI:24621 ! hormone [Term] id: CHEBI:50113 name: androgen is_a: CHEBI:50112 ! sex hormone [Term] id: CHEBI:50114 name: estrogen is_a: CHEBI:50112 ! sex hormone [Term] id: CHEBI:50115 name: hyponitrite(1-) is_a: CHEBI:33458 ! nitrogen oxoanion [Term] id: CHEBI:50116 name: 4-hydroxy-3-octaprenylbenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid [Term] id: CHEBI:50117 name: phenylglyoxylyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:50118 name: (6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:50121 name: 1,2-thiazolidine subset: chebi_ph7_3 is_a: CHEBI:38333 ! thiazolidine [Term] id: CHEBI:50126 name: tetrasaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:50127 name: trifluoromethyl group subset: chebi_ph7_3 is_a: CHEBI:50491 ! haloalkyl group [Term] id: CHEBI:50129 name: 2-hydroxyisobutyric acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:50130 name: monacolin L subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:75885 ! 2-pyranones relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:50141 name: bronchoconstrictor agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50157 name: (5-hydroxyindol-3-yl)acetaldehyde subset: chebi_ph7_3 is_a: CHEBI:24823 ! indoleacetaldehyde is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50160 name: steroid acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:50163 name: alpha-glutamyl phosphate is_a: CHEBI:21314 ! glutamyl phosphate [Term] id: CHEBI:50164 name: gamma-glutamyl phosphate is_a: CHEBI:21314 ! glutamyl phosphate [Term] id: CHEBI:50166 name: D-gamma-glutamyl phosphate is_a: CHEBI:50164 ! gamma-glutamyl phosphate [Term] id: CHEBI:50168 name: 3-hydroxypregnan-20-one subset: chebi_ph7_3 is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:50169 name: brexanolone subset: chebi_ph7_3 is_a: CHEBI:50170 ! 3-hydroxy-5alpha-pregnan-20-one relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:35717 ! sedative relationship: has_role CHEBI:38877 ! intravenous anaesthetic relationship: has_role CHEBI:50268 ! GABA modulator relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:5017 name: ferredoxin is_a: CHEBI:35135 ! iron-sulfur protein relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:50170 name: 3-hydroxy-5alpha-pregnan-20-one subset: chebi_ph7_3 is_a: CHEBI:50168 ! 3-hydroxypregnan-20-one [Term] id: CHEBI:50171 name: 3-hydroxy-5beta-pregnan-20-one subset: chebi_ph7_3 is_a: CHEBI:50168 ! 3-hydroxypregnan-20-one [Term] id: CHEBI:50176 name: keratolytic drug is_a: CHEBI:50177 ! dermatologic drug [Term] id: CHEBI:50177 name: dermatologic drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50183 name: P450 inhibitor is_a: CHEBI:76898 ! EC 1.14.14.1 (unspecific monooxygenase) inhibitor [Term] id: CHEBI:50185 name: fatty acid synthesis inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:50188 name: provitamin is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:5019 name: ferrichrome subset: chebi_ph7_3 is_a: CHEBI:61414 ! ferrichromes relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50191 name: trideoxyhexose is_a: CHEBI:23628 ! deoxyhexose [Term] id: CHEBI:50193 name: quinone imine is_a: CHEBI:24783 ! imine [Term] id: CHEBI:50196 name: dihydroxybenzaldehyde is_a: CHEBI:22698 ! benzaldehydes is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:50201 name: (R)-naringenin subset: chebi_ph7_3 is_a: CHEBI:50202 ! naringenin [Term] id: CHEBI:50202 name: naringenin subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:38739 ! trihydroxyflavanone [Term] id: CHEBI:50205 name: 3,4-dihydroxybenzaldehyde subset: chebi_ph7_3 is_a: CHEBI:50196 ! dihydroxybenzaldehyde [Term] id: CHEBI:50207 name: sophoraflavanone B subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:38739 ! trihydroxyflavanone relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50208 name: leachianone G subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:38742 ! tetrahydroxyflavanone [Term] id: CHEBI:50209 name: sophoraflavanone G subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:140377 ! (2S)-flavan-4-one is_a: CHEBI:38742 ! tetrahydroxyflavanone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50210 name: 7-methyl-GTP is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:50211 name: retinol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50215 name: dihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:25186 ! p-menthane monoterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50218 name: EC 3.1.4.* (phosphoric diester hydrolase) inhibitor is_a: CHEBI:76760 ! EC 3.1.* (ester hydrolase) inhibitor [Term] id: CHEBI:50226 name: 7-methyl-GTP(1+) is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:50229 name: Schiff base is_a: CHEBI:24783 ! imine [Term] id: CHEBI:50232 name: (+)-neoisodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol [Term] id: CHEBI:50233 name: (+)-isodihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol [Term] id: CHEBI:50235 name: (+)-dihydrocarveol subset: chebi_ph7_3 is_a: CHEBI:50215 ! dihydrocarveol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50238 name: 4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:50239 ! epsilon-lactone [Term] id: CHEBI:50239 name: epsilon-lactone is_a: CHEBI:25000 ! lactone [Term] id: CHEBI:50243 name: 7-isopropyl-4-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:50239 ! epsilon-lactone [Term] id: CHEBI:50244 name: (1R,2R,4S)-limonene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:17219 ! limonene-1,2-diol [Term] id: CHEBI:50245 name: (1R,4S)-1-hydroxylimonen-2-one subset: chebi_ph7_3 is_a: CHEBI:50246 ! 1-hydroxylimonen-2-one [Term] id: CHEBI:50246 name: 1-hydroxylimonen-2-one subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25040 ! limonene monoterpenoid [Term] id: CHEBI:50247 name: antidote is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:50248 name: hematologic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50249 name: anticoagulant is_a: CHEBI:50248 ! hematologic agent [Term] id: CHEBI:50250 name: (4R,7S)-7-isopropyl-4-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:37668 ! terpene lactone is_a: CHEBI:50243 ! 7-isopropyl-4-methyloxepan-2-one relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50253 name: allofuranose is_a: CHEBI:37690 ! allose [Term] id: CHEBI:50254 name: D-allofuranose subset: chebi_ph7_3 is_a: CHEBI:50253 ! allofuranose [Term] id: CHEBI:50256 name: beta-D-allofuranose subset: chebi_ph7_3 is_a: CHEBI:50254 ! D-allofuranose [Term] id: CHEBI:50257 name: L-allofuranose subset: chebi_ph7_3 is_a: CHEBI:50253 ! allofuranose [Term] id: CHEBI:50259 name: beta-L-allofuranose subset: chebi_ph7_3 is_a: CHEBI:50257 ! L-allofuranose [Term] id: CHEBI:50260 name: 5-methylthio-2-oxopentanoic acid is_a: CHEBI:134529 ! omega-(methylthio)-2-oxocarboxylic acid [Term] id: CHEBI:50261 name: 2-(2-methylthioethyl)malic acid is_a: CHEBI:134530 ! 2-(omega-methylthio)alkylmalic acid [Term] id: CHEBI:50262 name: 2-(3-methylthiopropyl)malic acid is_a: CHEBI:134530 ! 2-(omega-methylthio)alkylmalic acid [Term] id: CHEBI:50263 name: 2-hydroxydicarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:50266 name: prodrug is_a: CHEBI:136859 ! pro-agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50267 name: protective agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50268 name: GABA modulator is_a: CHEBI:38632 ! membrane transport modulator is_a: CHEBI:51374 ! GABA agent [Term] id: CHEBI:50269 name: EC 1.1.1.1 (alcohol dehydrogenase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:50271 name: (1R,2S,5S,6S)-2-(3-carboxypropanoyl)-5-[(1-carboxyvinyl)oxy]-6-hydroxycyclohex-3-ene-1-carboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50272 name: chrysanthemyl diphosphate is_a: CHEBI:25412 ! monoterpenyl phosphate [Term] id: CHEBI:50273 name: (R,R)-chrysanthemyl diphosphate is_a: CHEBI:50272 ! chrysanthemyl diphosphate [Term] id: CHEBI:50274 name: secoiridoid glycoside is_a: CHEBI:139166 ! secoiridoid is_a: CHEBI:61777 ! terpene glycoside [Term] id: CHEBI:50276 name: EC 5.99.1.2 (DNA topoisomerase) inhibitor is_a: CHEBI:70727 ! topoisomerase inhibitor [Term] id: CHEBI:50277 name: farnesyl diphosphate is_a: CHEBI:24018 ! farnesyl phosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:50279 name: (1S,2S,3S)-prephytoene diphosphate is_a: CHEBI:14885 ! prephytoene diphosphate [Term] id: CHEBI:50280 name: (R)-lavandulyl diphosphate is_a: CHEBI:50284 ! lavandulyl diphosphate [Term] id: CHEBI:50281 name: lavandulol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25409 ! monoterpenoid relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50282 name: (S)-lavandulol subset: chebi_ph7_3 is_a: CHEBI:50281 ! lavandulol [Term] id: CHEBI:50283 name: (R)-lavandulol subset: chebi_ph7_3 is_a: CHEBI:50281 ! lavandulol [Term] id: CHEBI:50284 name: lavandulyl diphosphate is_a: CHEBI:46731 ! alkyl diphosphate [Term] id: CHEBI:50297 name: canonical nucleotide residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:50298 name: canonical deoxyribonucleotide residue is_a: CHEBI:50297 ! canonical nucleotide residue [Term] id: CHEBI:50299 name: canonical ribonucleotide residue is_a: CHEBI:50297 ! canonical nucleotide residue [Term] id: CHEBI:50300 name: thymidine 5'-monophosphate residue is_a: CHEBI:50298 ! canonical deoxyribonucleotide residue [Term] id: CHEBI:50302 name: terpentetriene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50303 name: terpentedienyl diphosphate is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:50305 name: podophyllotoxin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50307 ! furonaphthodioxole relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50176 ! keratolytic drug relationship: has_role CHEBI:60832 ! tubulin modulator relationship: has_role CHEBI:61951 ! microtubule-destabilising agent relationship: has_role CHEBI:64911 ! antimitotic relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50306 name: adenosine 5'-monophosphate residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:50307 name: furonaphthodioxole is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:50308 name: cytidine 5'-monophosphate residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:50312 name: onium compound is_a: CHEBI:37577 ! heteroatomic molecular entity [Term] id: CHEBI:50313 name: onium cation is_a: CHEBI:50312 ! onium compound [Term] id: CHEBI:50314 name: fluoronium subset: chebi_ph7_3 is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:50315 name: chloronium subset: chebi_ph7_3 is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:50316 name: bromonium subset: chebi_ph7_3 is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:50317 name: iodonium subset: chebi_ph7_3 is_a: CHEBI:50313 ! onium cation [Term] id: CHEBI:50319 name: nucleotide residue is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:50320 name: nucleoside residue is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:50321 name: 2'-deoxycytidine 5'-monophosphate residue is_a: CHEBI:50298 ! canonical deoxyribonucleotide residue [Term] id: CHEBI:50322 name: 2'-deoxyguanosine 5'-monophosphate residue is_a: CHEBI:50298 ! canonical deoxyribonucleotide residue is_a: CHEBI:60801 ! guanyl deoxyribonucleotide residue [Term] id: CHEBI:50323 name: 2'-deoxyadenosine 5'-monophosphate residue is_a: CHEBI:50298 ! canonical deoxyribonucleotide residue relationship: has_part CHEBI:139094 ! 2'-deoxyribose 5'-monophosphate residue [Term] id: CHEBI:50324 name: guanosine 5'-monophosphate residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:50325 name: proteinogenic amino-acid side-chain group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:50326 name: sulfanylmethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50327 name: selanylmethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50329 name: 2-carboxyethyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50330 name: 2-amino-2-oxoethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50331 name: 3-amino-3-oxopropyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50334 name: pyridinium ion is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:50335 name: organic nitrogen anion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:50336 name: 4-hydroxybenzyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50337 name: 1H-indol-3-ylmethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50338 name: 1H-imidazol-4-ylmethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50339 name: 4-aminobutyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50340 name: 3-carbamimidamidopropyl group is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50341 name: 1-hydroxyethyl group subset: chebi_ph7_3 is_a: CHEBI:50325 ! proteinogenic amino-acid side-chain group [Term] id: CHEBI:50342 name: L-proline residue subset: chebi_ph7_3 is_a: CHEBI:32874 ! proline residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:50347 name: L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:32664 ! asparagine residue is_a: CHEBI:33700 ! proteinogenic amino-acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:50348 name: L-asparaginyl group subset: chebi_ph7_3 is_a: CHEBI:22656 ! asparaginyl group is_a: CHEBI:33716 ! N-terminal proteinogenic amino-acid residue [Term] id: CHEBI:50349 name: D-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:32664 ! asparagine residue [Term] id: CHEBI:50351 name: cyclopropanecarboxylate ester is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:51454 ! cyclopropanes [Term] id: CHEBI:50360 name: (-)-1,2-campholide subset: chebi_ph7_3 is_a: CHEBI:488 ! 1,2-campholide [Term] id: CHEBI:50361 name: ketolactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:50367 name: taxane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:50370 name: parasympatholytic is_a: CHEBI:48873 ! cholinergic antagonist [Term] id: CHEBI:50371 name: (R)-rosmarinic acid is_a: CHEBI:17226 ! rosmarinic acid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50372 name: (S)-rosmarinic acid is_a: CHEBI:17226 ! rosmarinic acid [Term] id: CHEBI:50375 name: dihydromethanophenazine subset: chebi_ph7_3 is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:50383 name: nicotinamide mononucleotide is_a: CHEBI:25527 ! nicotinamide nucleotide is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:50387 name: tuberculosinol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:50388 name: tuberculosinyl diphosphate is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:50389 name: alpha-D-Glcp-(1->6)-alpha-D-Glcp-(1->6)-alpha-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:146180 ! glucotriose [Term] id: CHEBI:50390 name: EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor is_a: CHEBI:76866 ! EC 1.6.5.* (oxidoreductase acting on NADH or NADPH with a quinone or similar as acceptor) inhibitor [Term] id: CHEBI:50398 name: succinamic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:50401 name: cholestanoid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:50402 name: androstanoid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:50403 name: ergostanoid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:50404 name: lipoprotein cholesterol is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:50406 name: probe is_a: CHEBI:33232 ! application [Term] id: CHEBI:50408 name: visual indicator is_a: CHEBI:47867 ! indicator [Term] id: CHEBI:50410 name: colour indicator is_a: CHEBI:50408 ! visual indicator [Term] id: CHEBI:50411 name: one-colour indicator is_a: CHEBI:50410 ! colour indicator [Term] id: CHEBI:50413 name: hydroxyaldehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:50418 name: 4-hydroxyphenylglycine is_a: CHEBI:24662 ! hydroxy-amino acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:50425 name: inorganic disulfide is_a: CHEBI:48343 ! disulfide [Term] id: CHEBI:50427 name: platelet aggregation inhibitor is_a: CHEBI:50248 ! hematologic agent [Term] id: CHEBI:50429 name: (Z)-glutaconic acid is_a: CHEBI:24309 ! glutaconic acid [Term] id: CHEBI:50436 name: 10beta-hydroxytaxa-4(20),11-dien-5alpha-yl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:50441 name: N-substituted diamine is_a: CHEBI:23666 ! diamine [Term] id: CHEBI:50442 name: N-substituted cadaverine is_a: CHEBI:50441 ! N-substituted diamine [Term] id: CHEBI:50445 name: EC 3.5.4.4 (adenosine deaminase) inhibitor is_a: CHEBI:76809 ! EC 3.5.4.* (non-peptide cyclic amidine C-N hydrolase) inhibitor [Term] id: CHEBI:50446 name: 3-(hydroxyamino)phenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:50447 name: (S)-carnitinamide subset: chebi_ph7_3 is_a: CHEBI:48604 ! carnitinamide [Term] id: CHEBI:50448 name: naphthylamine is_a: CHEBI:38034 ! aminonaphthalene is_a: CHEBI:50471 ! primary arylamine [Term] id: CHEBI:50450 name: 1-naphthylamine subset: chebi_ph7_3 is_a: CHEBI:50448 ! naphthylamine relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:50451 name: 6-hydroxy-3,7-dimethyloctanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:50452 name: 6-hydroxy-3-isopropenylheptanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:50464 name: cis-vaccenic acid is_a: CHEBI:36023 ! vaccenic acid [Term] id: CHEBI:50465 name: 2-decenoic acid is_a: CHEBI:36003 ! decenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:50467 name: trans-2-decenoic acid is_a: CHEBI:50465 ! 2-decenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50469 name: EC 3.1.1.4 (phospholipase A2) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:50471 name: primary arylamine subset: chebi_ph7_3 is_a: CHEBI:32877 ! primary amine is_a: CHEBI:33860 ! aromatic amine [Term] id: CHEBI:50477 name: butyrate ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:50491 name: haloalkyl group is_a: CHEBI:33249 ! organyl group [Term] id: CHEBI:50492 name: thiocarbonyl compound is_a: CHEBI:33261 ! organosulfur compound relationship: has_part CHEBI:30256 ! thiocarbonyl group [Term] id: CHEBI:50498 name: vaccenate(1-) subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion [Term] id: CHEBI:50502 name: EC 2.5.1.15 (dihydropteroate synthase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:50503 name: laxative is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50504 name: osmotic diuretic is_a: CHEBI:35498 ! diuretic [Term] id: CHEBI:50505 name: sweetening agent is_a: CHEBI:35617 ! flavouring agent [Term] id: CHEBI:50509 name: potassium channel blocker is_a: CHEBI:50510 ! potassium channel modulator [Term] id: CHEBI:50510 name: potassium channel modulator is_a: CHEBI:38632 ! membrane transport modulator [Term] id: CHEBI:50511 name: bipyridines is_a: CHEBI:36820 ! ring assembly is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:64459 ! biaryl [Term] id: CHEBI:50513 name: mydriatic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50514 name: vasoconstrictor agent is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:50515 name: 24-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:50516 name: (24R)-24-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:50515 ! 24-hydroxycholesterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:90709 ! nuclear receptor modulator [Term] id: CHEBI:50517 name: 7alpha,24-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:50519 name: sulfoacetic acid is_a: CHEBI:38031 ! carboxyalkanesulfonic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50521 name: N-methylnicotinic acid is_a: CHEBI:50334 ! pyridinium ion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50523 name: butenolide is_a: CHEBI:24129 ! furans is_a: CHEBI:37581 ! gamma-lactone [Term] id: CHEBI:50524 name: catecholate(1-) is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50525 name: phenolate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:50526 name: phenolate is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:50528 name: FMNH(.) is_a: CHEBI:24041 ! flavin mononucleotide [Term] id: CHEBI:50531 name: (R)-beta-alanopine is_a: CHEBI:15337 ! beta-alanopine [Term] id: CHEBI:50532 name: (S)-beta-alanopine is_a: CHEBI:15337 ! beta-alanopine [Term] id: CHEBI:50540 name: (S)-cis-N-methylcanadine subset: chebi_ph7_3 is_a: CHEBI:16512 ! (S)-N-methylcanadine is_a: CHEBI:194529 ! an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine [Term] id: CHEBI:50542 name: menthofuran subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:38830 ! 1-benzofurans relationship: has_role CHEBI:25491 ! nematicide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50544 name: (-)-menthofuran subset: chebi_ph7_3 is_a: CHEBI:50542 ! menthofuran [Term] id: CHEBI:50545 name: trans-isoeugenol subset: chebi_ph7_3 is_a: CHEBI:18224 ! isoeugenol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:50547 name: 3-(beta-D-ribofuranosyl)uric acid subset: chebi_ph7_3 is_a: CHEBI:50549 ! (beta-D-ribofuranosyl)uric acid [Term] id: CHEBI:50549 name: (beta-D-ribofuranosyl)uric acid is_a: CHEBI:26399 ! purine ribonucleoside [Term] id: CHEBI:50562 name: tartrate salt is_a: CHEBI:24868 ! organic salt [Term] id: CHEBI:50563 name: iridoid monoterpenoid is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:50565 name: N-acetyl-beta-D-glucosamine 6-phosphate is_a: CHEBI:15784 ! N-acetyl-D-glucosamine 6-phosphate [Term] id: CHEBI:50566 name: nitric oxide donor is_a: CHEBI:17891 ! donor [Term] id: CHEBI:50570 name: trans-2-octadecenoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50571 name: 3-oxooctadecanoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50572 name: trans-octadec-2-enoic acid is_a: CHEBI:50573 ! octadec-2-enoic acid [Term] id: CHEBI:50573 name: octadec-2-enoic acid is_a: CHEBI:25634 ! octadecenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:50574 name: octadec-2-ene subset: chebi_ph7_3 is_a: CHEBI:37606 ! octadecene [Term] id: CHEBI:50576 name: 3-oxooctadecanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid [Term] id: CHEBI:50578 name: 3-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:50582 name: alkenyl alcohol is_a: CHEBI:2571 ! aliphatic alcohol is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:50583 name: 3-hydroxyoctadecanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50584 name: alkyl alcohol is_a: CHEBI:2571 ! aliphatic alcohol [Term] id: CHEBI:50586 name: 9xi-episterol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:50591 name: 4beta-methylzymosterol-4alpha-carboxylic acid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:50593 name: 3-dehydro-4-methylzymosterol subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50599 name: N(tele)-methyl-L-histidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50601 name: N(alpha)-methyl-L-histidine is_a: CHEBI:21911 ! N(alpha)-methyl-L-histidines [Term] id: CHEBI:50602 name: precorrin-2 is_a: CHEBI:26228 ! precorrin is_a: CHEBI:52582 ! isobacteriochlorins relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50604 name: 5-(methylsulfanyl)-2,3-dioxopentyl phosphate is_a: CHEBI:22327 ! aliphatic sulfide is_a: CHEBI:36948 ! oxoalkyl phosphate is_a: CHEBI:51869 ! alpha-diketone [Term] id: CHEBI:50605 name: 2-hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is_a: CHEBI:22327 ! aliphatic sulfide is_a: CHEBI:36948 ! oxoalkyl phosphate is_a: CHEBI:36949 ! hydroxyalkyl phosphate is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:50606 name: 2-hydroxy-3-oxobutyl phosphate is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:36948 ! oxoalkyl phosphate is_a: CHEBI:36949 ! hydroxyalkyl phosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50608 name: (2S)-2-hydroxy-3-oxobutyl phosphate is_a: CHEBI:50606 ! 2-hydroxy-3-oxobutyl phosphate [Term] id: CHEBI:50612 name: (R)-2-hydroxybutyric acid is_a: CHEBI:1148 ! 2-hydroxybutyric acid [Term] id: CHEBI:50613 name: (S)-2-hydroxybutyric acid is_a: CHEBI:1148 ! 2-hydroxybutyric acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid [Term] id: CHEBI:50616 name: iminoaspartic acid is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:33272 ! ketimine is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50621 name: gamma-glutamylalanine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:506227 name: N-acetyl-D-glucosamine subset: chebi_ph7_3 is_a: CHEBI:21601 ! N-acetyl-D-hexosamine is_a: CHEBI:59640 ! N-acetylglucosamine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:50626 name: 2-hydroxyhexadecanal subset: chebi_ph7_3 is_a: CHEBI:133318 ! hydroxy fatty aldehyde is_a: CHEBI:17176 ! long-chain fatty aldehyde relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:50627 name: EC 3.2.1.1 (alpha-amylase) inhibitor is_a: CHEBI:52424 ! EC 3.2.1.* (glycosidase) inhibitor [Term] id: CHEBI:50629 name: cyclooxygenase 2 inhibitor is_a: CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor [Term] id: CHEBI:50630 name: cyclooxygenase 1 inhibitor is_a: CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor [Term] id: CHEBI:50646 name: bone density conservation agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50648 name: 9-cis-retinoic acid is_a: CHEBI:26536 ! retinoic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50176 ! keratolytic drug relationship: has_role CHEBI:63794 ! retinoid X receptor agonist [Term] id: CHEBI:50660 name: 7-deazaguanine ribonucleoside is_a: CHEBI:18254 ! ribonucleoside [Term] id: CHEBI:50661 name: loliose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:50667 name: mercaptopurine subset: chebi_ph7_3 is_a: CHEBI:26401 ! purines relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:50671 name: antithyroid drug is_a: CHEBI:49020 ! hormone antagonist [Term] id: CHEBI:50674 name: chitobioses is_a: CHEBI:22480 ! amino disaccharide [Term] id: CHEBI:50675 name: beta-D-glucosaminyl-(1->4)-D-glucosamine is_a: CHEBI:50674 ! chitobioses [Term] id: CHEBI:50680 name: methotrexate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:50681 name: methotrexate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:50683 name: EC 1.5.1.3 (dihydrofolate reductase) inhibitor is_a: CHEBI:73913 ! antifolate is_a: CHEBI:76863 ! EC 1.5.1.* (oxidoreductase acting on donor CH-NH group, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:50684 name: cross-linking reagent is_a: CHEBI:33893 ! reagent [Term] id: CHEBI:50689 name: reproductive control drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50691 name: abortifacient is_a: CHEBI:50689 ! reproductive control drug [Term] id: CHEBI:50694 name: minocycline is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26895 ! tetracyclines is_a: CHEBI:48132 ! tetracenomycin relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:50695 name: monobactam is_a: CHEBI:27933 ! beta-lactam antibiotic [Term] id: CHEBI:50699 name: oligosaccharide is_a: CHEBI:16646 ! carbohydrate is_a: CHEBI:167559 ! glycan [Term] id: CHEBI:5070 name: flavanone subset: chebi_ph7_3 is_a: CHEBI:28863 ! flavanones [Term] id: CHEBI:50700 name: 5-(methylsulfanyl)pentanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:50701 name: 6-(methylsulfanyl)hexanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:50702 name: 7-(methylsulfanyl)heptanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:50703 name: 8-(methylsulfanyl)octanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:50704 name: 9-(methylsulfanyl)nonanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:50707 name: homomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:50710 name: dihomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:50711 name: trihomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:50712 name: tetrahomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:50713 name: pentahomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:50714 name: hexahomomethionine is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:50715 name: methylnaphthalene is_a: CHEBI:25477 ! naphthalenes [Term] id: CHEBI:50723 name: (Z)-phenylacetaldehyde oxime subset: chebi_ph7_3 is_a: CHEBI:47791 ! phenylacetaldehyde oxime [Term] id: CHEBI:50725 name: 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phosphate is_a: CHEBI:16266 ! 2,3-bis-O-(geranylgeranyl)glycerol 1-phosphate [Term] id: CHEBI:50726 name: CDP-2,3-bis-O-(geranylgeranyl)-sn-glycerol is_a: CHEBI:47784 ! nucleotide conjugate [Term] id: CHEBI:50733 name: nutraceutical is_a: CHEBI:23888 ! drug [Term] id: CHEBI:507393 name: taurine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:50745 name: progestogen is_a: CHEBI:50112 ! sex hormone [Term] id: CHEBI:50746 name: N(6)-dihydrolipoyl-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:50748 name: antipsoriatic is_a: CHEBI:50177 ! dermatologic drug [Term] id: CHEBI:507499 name: tricetin is_a: CHEBI:25883 ! pentahydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:50750 name: EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor is_a: CHEBI:70727 ! topoisomerase inhibitor [Term] id: CHEBI:50751 name: anti-estrogen is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50753 name: isoflavonoid is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:38443 ! 1-benzopyran is_a: CHEBI:72544 ! flavonoids [Term] id: CHEBI:50754 name: cyclohexanecarboxylate ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:50758 name: N-hydroxydihomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50759 name: N-formyl amino acid is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:50760 name: N-hydroxy-alpha-amino-acid is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:24709 ! hydroxylamines [Term] id: CHEBI:50761 name: N-hydroxytrihomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50762 name: N-hydroxytetrahomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50763 name: N-hydroxypentahomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50764 name: N-hydroxyhexahomomethionine is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50765 name: N,N-dihydroxyhexahomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:50766 name: N,N-dihydroxy-alpha-amino acid is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid [Term] id: CHEBI:50767 name: N,N-dihydroxydihomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:50768 name: N,N-dihydroxytrihomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:50769 name: N,N-dihydroxytetrahomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:50770 name: N,N-dihydroxypentahomomethionine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid [Term] id: CHEBI:50774 name: 2-decaprenyl-6-methoxyphenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50775 name: 3-decaprenyl-4,5-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50776 name: 3-decaprenyl-4-hydroxy-5-methoxybenzoic acid is_a: CHEBI:25238 ! methoxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:50779 name: appetite enhancer is_a: CHEBI:50780 ! appetite regulator [Term] id: CHEBI:5078 name: flavonol subset: chebi_ph7_3 is_a: CHEBI:28802 ! flavonols is_a: CHEBI:38687 ! monohydroxyflavone [Term] id: CHEBI:50780 name: appetite regulator is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50781 name: EC 1.3.1.22 [3-oxo-5alpha-steroid 4-dehydrogenase (NADP(+))] inhibitor is_a: CHEBI:76857 ! EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:50783 name: ent-isokaurene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:50786 name: anabolic androgenic steroid is_a: CHEBI:26764 ! steroid hormone relationship: has_role CHEBI:36413 ! anabolic agent relationship: has_role CHEBI:50113 ! androgen [Term] id: CHEBI:50787 name: L-erythro-3-methylmalic acid is_a: CHEBI:23948 ! erythro-3-methylmalic acid [Term] id: CHEBI:50789 name: (3S)-3-hydroxy-L-asparagine is_a: CHEBI:52987 ! L-asparagine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:50793 name: 2-methyl-3-oxosuccinic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid [Term] id: CHEBI:50830 name: fluorinated steroid is_a: CHEBI:35341 ! steroid is_a: CHEBI:37143 ! organofluorine compound [Term] id: CHEBI:50846 name: immunomodulator is_a: CHEBI:23888 ! drug is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:50847 name: immunological adjuvant is_a: CHEBI:50846 ! immunomodulator is_a: CHEBI:60809 ! adjuvant [Term] id: CHEBI:50855 name: antiatherogenic agent is_a: CHEBI:35554 ! cardiovascular drug [Term] id: CHEBI:50857 name: anti-allergic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50858 name: corticosteroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:50860 name: organic molecular entity is_a: CHEBI:33582 ! carbon group molecular entity relationship: has_part CHEBI:27594 ! carbon atom [Term] id: CHEBI:50864 name: insulin-sensitizing drug is_a: CHEBI:35526 ! hypoglycemic agent is_a: CHEBI:48705 ! agonist is_a: CHEBI:70781 ! PPAR modulator [Term] id: CHEBI:50871 name: valerate ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:50887 name: haloarene is_a: CHEBI:24472 ! halohydrocarbon [Term] id: CHEBI:50893 name: azaarene is_a: CHEBI:33833 ! heteroarene is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:50902 name: genotoxin is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50903 name: carcinogenic agent is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50904 name: allergen is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50905 name: teratogenic agent is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50906 name: role [Term] id: CHEBI:50908 name: hepatotoxic agent is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50909 name: nephrotoxic agent is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50910 name: neurotoxin is_a: CHEBI:52209 ! aetiopathogenetic role is_a: CHEBI:64909 ! poison [Term] id: CHEBI:50912 name: cardiotoxic agent is_a: CHEBI:52209 ! aetiopathogenetic role [Term] id: CHEBI:50914 name: EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor is_a: CHEBI:50916 ! lipid kinase inhibitor is_a: CHEBI:76881 ! EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor [Term] id: CHEBI:50916 name: lipid kinase inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:50918 name: pyrroloquinoline is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:50919 name: antiemetic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50920 name: 2D-2,3,5/4,6-pentahydroxycyclohexanone subset: chebi_ph7_3 is_a: CHEBI:25881 ! pentahydroxycyclohexanone [Term] id: CHEBI:50923 name: 5-deoxy-D-glucuronic acid is_a: CHEBI:33886 ! glucuronic acids [Term] id: CHEBI:50925 name: EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor is_a: CHEBI:76812 ! EC 2.7.11.* (protein-serine/threonine kinase) inhibitor [Term] id: CHEBI:50926 name: angiogenesis modulating agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:50934 name: N-acyl-Delta(8)-phytosphingenine subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide [Term] id: CHEBI:50948 name: (2S,3S)-2-methylcitric acid is_a: CHEBI:30835 ! 2-methylcitric acid [Term] id: CHEBI:50949 name: serotonin uptake inhibitor is_a: CHEBI:48278 ! serotonergic drug [Term] id: CHEBI:50955 name: arsonic acids is_a: CHEBI:33407 ! arsenic oxoacid [Term] id: CHEBI:50956 name: organoarsonic acid anion is_a: CHEBI:33406 ! organoarsenic compound [Term] id: CHEBI:50967 name: non-covalently-bound molecular entity is_a: CHEBI:36357 ! polyatomic entity [Term] id: CHEBI:50972 name: 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate is_a: CHEBI:25500 ! neopterins is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:50981 name: secondary aliphatic amine is_a: CHEBI:32863 ! secondary amine [Term] id: CHEBI:50994 name: primary amino compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:50995 name: secondary amino compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:50996 name: tertiary amino compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:50998 name: trans-2-enoyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:51006 name: unsaturated fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:51013 name: beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36541 ! sialotriaosylceramide is_a: CHEBI:79217 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:51014 name: (S)-styrene oxide subset: chebi_ph7_3 is_a: CHEBI:17907 ! styrene oxide [Term] id: CHEBI:51022 name: 1,3-dihydro-2H-imidazol-2-one subset: chebi_ph7_3 is_a: CHEBI:24781 ! imidazolinone [Term] id: CHEBI:51026 name: macrocycle is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:51039 name: dopamine uptake inhibitor is_a: CHEBI:48560 ! dopaminergic agent [Term] id: CHEBI:51051 name: N-(3-acetamidopropyl)-4-aminobutanal is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:51057 name: 3-phenylpropionate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:51060 name: hormone agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:51061 ! hormone receptor modulator [Term] id: CHEBI:51061 name: hormone receptor modulator is_a: CHEBI:23888 ! drug is_a: CHEBI:90710 ! receptor modulator [Term] id: CHEBI:51069 name: organic halide salt is_a: CHEBI:24868 ! organic salt [Term] id: CHEBI:51075 name: sophorolipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:51078 name: 13-sophorosyloxydocosanoate 6',6''-diacetate is_a: CHEBI:51075 ! sophorolipid [Term] id: CHEBI:51080 name: nitrate ester is_a: CHEBI:36963 ! organooxygen compound is_a: CHEBI:51081 ! nitrates [Term] id: CHEBI:51081 name: nitrates is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:51086 name: chemical role is_a: CHEBI:50906 ! role [Term] id: CHEBI:51119 name: tricyclic hydrocarbon is_a: CHEBI:33666 ! polycyclic hydrocarbon [Term] id: CHEBI:51120 name: ortho- and peri-fused tricyclic hydrocarbon is_a: CHEBI:51119 ! tricyclic hydrocarbon [Term] id: CHEBI:51121 name: fluorescent dye is_a: CHEBI:37958 ! dye [Term] id: CHEBI:51129 name: nitrohydrocarbon is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:51132 name: nitroarene is_a: CHEBI:51129 ! nitrohydrocarbon [Term] id: CHEBI:51143 name: nitrogen molecular entity is_a: CHEBI:33302 ! pnictogen molecular entity relationship: has_part CHEBI:25555 ! nitrogen atom [Term] id: CHEBI:51144 name: nitrogen group is_a: CHEBI:24433 ! group [Term] id: CHEBI:51149 name: xanthones is_a: CHEBI:38835 ! xanthenes is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:5115 name: monofluorobenzene subset: chebi_ph7_3 is_a: CHEBI:83575 ! monofluorobenzenes [Term] id: CHEBI:51151 name: dipolar compound is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:51177 name: antitussive is_a: CHEBI:23888 ! drug [Term] id: CHEBI:5118 name: fluoxetine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:86991 ! (R)-fluoxetine relationship: has_part CHEBI:86992 ! (S)-fluoxetine relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:51197 name: calixaromatic is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:51026 ! macrocycle [Term] id: CHEBI:51214 name: diamminedichloroplatinum is_a: CHEBI:33862 ! platinum coordination entity [Term] id: CHEBI:51269 name: acenes is_a: CHEBI:33836 ! benzenoid aromatic compound [Term] id: CHEBI:51270 name: tetracenes is_a: CHEBI:51269 ! acenes [Term] id: CHEBI:51276 name: thioureas is_a: CHEBI:50492 ! thiocarbonyl compound [Term] id: CHEBI:51277 name: thioester subset: chebi_ph7_3 is_a: CHEBI:26959 ! thiocarboxylic ester is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:51282 name: 2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid is_a: CHEBI:63394 ! ketoaldonic acid derivative [Term] id: CHEBI:51283 name: hydroxypyruvaldehyde phosphate is_a: CHEBI:27659 ! 2-oxo aldehyde [Term] id: CHEBI:51284 name: 1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:51285 name: acenoquinone is_a: CHEBI:36141 ! quinone is_a: CHEBI:51269 ! acenes [Term] id: CHEBI:51286 name: tetracenequinones is_a: CHEBI:51285 ! acenoquinone is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:513 name: 1,3,4,6-tetrachlorocyclohexa-1,4-diene subset: chebi_ph7_3 is_a: CHEBI:37613 ! cyclohexadiene is_a: CHEBI:39482 ! chloroolefin [Term] id: CHEBI:5130 name: flurbiprofen is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38679 ! fluorobiphenyl relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor [Term] id: CHEBI:51307 name: diester is_a: CHEBI:35701 ! ester [Term] id: CHEBI:51308 name: dinitrile is_a: CHEBI:18379 ! nitrile [Term] id: CHEBI:51309 name: N(2)-succinyl-L-citrulline is_a: CHEBI:21815 ! N2-acyl-L-ornithine [Term] id: CHEBI:51310 name: futalosine is_a: CHEBI:24844 ! inosines [Term] id: CHEBI:51312 name: dehypoxanthine futalosine is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:51316 name: haloethene is_a: CHEBI:5610 ! haloalkene [Term] id: CHEBI:51323 name: cinchona alkaloid is_a: CHEBI:26509 ! quinoline alkaloid [Term] id: CHEBI:51324 name: vinylarene is_a: CHEBI:33658 ! arene [Term] id: CHEBI:51333 name: sulfenic acid derivative is_a: CHEBI:33424 ! sulfur oxoacid derivative [Term] id: CHEBI:51334 name: SO-thioperoxol subset: chebi_ph7_3 is_a: CHEBI:37864 ! thioperoxol is_a: CHEBI:51333 ! sulfenic acid derivative [Term] id: CHEBI:51339 name: adamantanes is_a: CHEBI:35294 ! carbopolycyclic compound [Term] id: CHEBI:51340 name: pristanic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:51341 name: pristanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:51349 name: polyamine macromolecule is_a: CHEBI:33839 ! macromolecule is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:51353 name: N-carbamoyl-L-alpha-amino acid is_a: CHEBI:21686 ! N-carbamoyl-L-amino acid [Term] id: CHEBI:51354 name: benzylpenicillin(1-) subset: chebi_ph7_3 is_a: CHEBI:51356 ! penicillinate anion [Term] id: CHEBI:51356 name: penicillinate anion subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:47811 ! penamcarboxylate [Term] id: CHEBI:51371 name: muscle relaxant is_a: CHEBI:51372 ! neuromuscular agent [Term] id: CHEBI:51372 name: neuromuscular agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:51373 name: GABA agonist is_a: CHEBI:51374 ! GABA agent [Term] id: CHEBI:51374 name: GABA agent is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:51384 name: D-ascorbic acid is_a: CHEBI:22652 ! ascorbic acid [Term] id: CHEBI:51387 name: calix(hetero)arene is_a: CHEBI:51197 ! calixaromatic [Term] id: CHEBI:51389 name: calixpyrroles is_a: CHEBI:51387 ! calix(hetero)arene [Term] id: CHEBI:51422 name: organodiyl group is_a: CHEBI:51446 ! organic divalent group [Term] id: CHEBI:51440 name: L-isoascorbic acid is_a: CHEBI:22652 ! ascorbic acid [Term] id: CHEBI:51446 name: organic divalent group is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:51447 name: organic univalent group is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:51453 name: (S)-carnitinium is_a: CHEBI:3424 ! carnitinium relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:51454 name: cyclopropanes is_a: CHEBI:33598 ! carbocyclic compound [Term] id: CHEBI:51458 name: (+)-epi-isozizaene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:51460 name: albaflavenone subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:49319 ! carbocyclic antibiotic is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:51475 name: naphthohydroquinone is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:24727 ! hydroxynaphthalene [Term] id: CHEBI:51478 name: albaflavenol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:51479 name: (5R)-albaflavenol subset: chebi_ph7_3 is_a: CHEBI:51478 ! albaflavenol [Term] id: CHEBI:51480 name: (5S)-albaflavenol subset: chebi_ph7_3 is_a: CHEBI:51478 ! albaflavenol [Term] id: CHEBI:51507 name: benzil subset: chebi_ph7_3 is_a: CHEBI:51869 ! alpha-diketone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:51509 name: (R)-benzoin subset: chebi_ph7_3 is_a: CHEBI:17682 ! benzoin [Term] id: CHEBI:51510 name: (S)-benzoin subset: chebi_ph7_3 is_a: CHEBI:17682 ! benzoin [Term] id: CHEBI:51545 name: 1,2-benzoxazoles is_a: CHEBI:51549 ! benzisoxazole [Term] id: CHEBI:51549 name: benzisoxazole is_a: CHEBI:46700 ! benzoxazole [Term] id: CHEBI:51569 name: N-acyl-amino acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:51570 name: biotins is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38295 ! azabicycloalkane is_a: CHEBI:38297 ! thiabicycloalkane is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:51571 name: diphenylethane is_a: CHEBI:33836 ! benzenoid aromatic compound [Term] id: CHEBI:51586 name: benzoins is_a: CHEBI:33854 ! aromatic alcohol is_a: CHEBI:51571 ! diphenylethane is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:51614 name: diarylmethane is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:51625 name: indolinone is_a: CHEBI:24829 ! indolones [Term] id: CHEBI:51652 name: dithianes is_a: CHEBI:36389 ! saturated organic heteromonocyclic parent is_a: CHEBI:38106 ! organosulfur heterocyclic compound [Term] id: CHEBI:51681 name: dimethoxybenzene is_a: CHEBI:51683 ! methoxybenzenes [Term] id: CHEBI:51683 name: methoxybenzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:51688 name: enal subset: chebi_ph7_3 is_a: CHEBI:51718 ! alpha,beta-unsaturated aldehyde is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:51689 name: enone subset: chebi_ph7_3 is_a: CHEBI:51721 ! alpha,beta-unsaturated ketone is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:5169 name: fraxetin subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:51702 name: enoate ester subset: chebi_ph7_3 is_a: CHEBI:51737 ! alpha,beta-unsaturated carboxylic ester is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:51703 name: glyoxylate group subset: chebi_ph7_3 is_a: CHEBI:33249 ! organyl group is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:51704 name: glyoxylates subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_part CHEBI:51703 ! glyoxylate group [Term] id: CHEBI:51705 name: octacarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:5171 name: friedelin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:51718 name: alpha,beta-unsaturated aldehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:51720 name: ynal subset: chebi_ph7_3 is_a: CHEBI:51718 ! alpha,beta-unsaturated aldehyde is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:51721 name: alpha,beta-unsaturated ketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:51732 name: cycloheptatriene is_a: CHEBI:36402 ! cycloalkatriene [Term] id: CHEBI:51737 name: alpha,beta-unsaturated carboxylic ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:51750 name: alpha,beta-unsaturated carboxylic acid amide is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:51751 name: enamide subset: chebi_ph7_3 is_a: CHEBI:51750 ! alpha,beta-unsaturated carboxylic acid amide is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:51793 name: (1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate is_a: CHEBI:18299 ! 1-C-(indol-3-yl)glycerol 3-phosphate [Term] id: CHEBI:51802 name: 4H-imidazole subset: chebi_ph7_3 is_a: CHEBI:14434 ! imidazole [Term] id: CHEBI:51822 name: 3,7-dideoxy-D-threo-hepto-2,6-diuolosonic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:51824 name: N-(3-aminopropyl)-4-aminobutanal is_a: CHEBI:17062 ! primary aliphatic amine is_a: CHEBI:50981 ! secondary aliphatic amine is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde [Term] id: CHEBI:51833 name: beta-D-fructofuranosyl alpha-D-mannopyranoside subset: chebi_ph7_3 is_a: CHEBI:24407 ! glycosyl glycoside [Term] id: CHEBI:51834 name: beta-D-fructofuranosyl alpha-D-mannopyranoside 6(F)-phosphate is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:51835 name: microthecin subset: chebi_ph7_3 is_a: CHEBI:131907 ! 3-pyrones relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:51836 name: 3,3'-biflaviolin is_a: CHEBI:36820 ! ring assembly [Term] id: CHEBI:51837 name: 3,8'-biflaviolin is_a: CHEBI:36820 ! ring assembly [Term] id: CHEBI:51847 name: ketoester is_a: CHEBI:17087 ! ketone is_a: CHEBI:35701 ! ester [Term] id: CHEBI:51848 name: alpha-ketoester is_a: CHEBI:51847 ! ketoester [Term] id: CHEBI:51849 name: beta-ketoester is_a: CHEBI:51847 ! ketoester [Term] id: CHEBI:51851 name: ketonitrile is_a: CHEBI:17087 ! ketone is_a: CHEBI:18379 ! nitrile [Term] id: CHEBI:51852 name: alpha-ketonitrile is_a: CHEBI:51851 ! ketonitrile [Term] id: CHEBI:51853 name: benzoyl cyanide subset: chebi_ph7_3 is_a: CHEBI:51852 ! alpha-ketonitrile is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:51856 name: methylphenidate(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:51857 name: methyl (S)-phenyl[(S)-piperidin-2-yl]acetate is_a: CHEBI:84276 ! methyl phenyl(piperidin-2-yl)acetate [Term] id: CHEBI:51860 name: dexmethylphenidate is_a: CHEBI:84276 ! methyl phenyl(piperidin-2-yl)acetate relationship: has_role CHEBI:37962 ! adrenergic agent [Term] id: CHEBI:51867 name: methyl ketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:51869 name: alpha-diketone is_a: CHEBI:46640 ! diketone [Term] id: CHEBI:51877 name: bisindole is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:51879 name: bisindole alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:51877 ! bisindole [Term] id: CHEBI:51914 name: organic heterohexacyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:51915 name: indolocarbazole is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:51921 name: heptadienal is_a: CHEBI:51688 ! enal [Term] id: CHEBI:51922 name: (E,E)-7-hydroxy-6-methylhepta-3,5-dienal subset: chebi_ph7_3 is_a: CHEBI:51921 ! heptadienal [Term] id: CHEBI:519567 name: 2'-O-methylisoliquiritigenin subset: chebi_ph7_3 is_a: CHEBI:23086 ! chalcones is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:51958 name: organic polycyclic compound is_a: CHEBI:33635 ! polycyclic compound is_a: CHEBI:33832 ! organic cyclic compound [Term] id: CHEBI:51959 name: organic tricyclic compound is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:51961 name: sesquarterpenoid is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:51963 name: hopanoid is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:51967 name: monochlorobenzoic acid is_a: CHEBI:23134 ! chlorobenzoic acid is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:51972 name: 12'-apo-carotenal subset: chebi_ph7_3 is_a: CHEBI:23041 ! carotenal [Term] id: CHEBI:51973 name: 9-cis-epoxycarotenoid subset: chebi_ph7_3 is_a: CHEBI:23043 ! epoxycarotenoid [Term] id: CHEBI:51978 name: oxonium betaine is_a: CHEBI:35281 ! onium betaine [Term] id: CHEBI:51985 name: alpha-linolenoyl-CoA is_a: CHEBI:139576 ! octadecatrienoyl-CoA is_a: CHEBI:76184 ! alpha-linolenoyl bioconjugate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52020 name: 6-decylubiquinone subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:52021 name: 6-decylubiquinol subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:51683 ! methoxybenzenes [Term] id: CHEBI:52022 name: taurohyocholic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid is_a: CHEBI:37793 ! amino sulfonic acid [Term] id: CHEBI:52023 name: hyodeoxycholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36248 ! 5beta-cholanic acids is_a: CHEBI:363227 ! 6alpha,20xi-murideoxycholic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52025 name: 8-hydroxyfurocoumarin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:52026 name: amorpha-4,11-diene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:52028 name: 8-methoxyfurocoumarin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:52030 name: murideoxycholic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52031 name: glycochenodeoxycholic acid 7-sulfate is_a: CHEBI:52035 ! sulfooxy steroid [Term] id: CHEBI:52035 name: sulfooxy steroid is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:52043 name: 7-methyl-3-oxooct-6-enoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:52045 name: 2-oxo-1,2-dihydroquinoline-4-carboxylic acid is_a: CHEBI:26512 ! quinolinemonocarboxylic acid [Term] id: CHEBI:52048 name: 2,3,5,6-tetrachlorophenol is_a: CHEBI:52049 ! tetrachlorophenol [Term] id: CHEBI:52049 name: tetrachlorophenol is_a: CHEBI:23150 ! chlorophenol is_a: CHEBI:26888 ! tetrachlorobenzene [Term] id: CHEBI:52050 name: (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:27458 ! 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA [Term] id: CHEBI:52051 name: benzyl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:90628 ! benzyl ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:52052 name: phenylacetone subset: chebi_ph7_3 is_a: CHEBI:26292 ! propanones is_a: CHEBI:51867 ! methyl ketone [Term] id: CHEBI:52057 name: N-acetylphosphinothricin is_a: CHEBI:22160 ! acetamides is_a: CHEBI:26044 ! phosphinic acids [Term] id: CHEBI:52058 name: 5-hydroxyfurocoumarin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:52061 name: 5-methoxyfurocoumarin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin [Term] id: CHEBI:52069 name: 3,5-dihydroxybiphenyl subset: chebi_ph7_3 is_a: CHEBI:22888 ! biphenyls [Term] id: CHEBI:52070 name: senecionine N-oxide subset: chebi_ph7_3 is_a: CHEBI:134363 ! tertiary amine oxide [Term] id: CHEBI:52075 name: all-trans-13,14-dihydroretinol subset: chebi_ph7_3 is_a: CHEBI:50211 ! retinol [Term] id: CHEBI:52076 name: gibberellin A3 O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:52079 name: N-acetyl-D-hexosamine 1-phosphate is_a: CHEBI:24584 ! hexosamine phosphate [Term] id: CHEBI:52086 name: glyceollin III subset: chebi_ph7_3 is_a: CHEBI:52130 ! benzofuropyranochromene relationship: has_role CHEBI:26115 ! phytoalexin relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:50751 ! anti-estrogen [Term] id: CHEBI:52090 name: methoxide is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52092 name: ethoxide is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52094 name: peroxy acid is_a: CHEBI:24833 ! oxoacid [Term] id: CHEBI:52127 name: (-)-glyceollin II subset: chebi_ph7_3 is_a: CHEBI:52130 ! benzofuropyranochromene relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:52130 name: benzofuropyranochromene is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:52135 name: steroidal acyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:52136 name: glufosinate is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:142852 ! glufosinate-P relationship: has_part CHEBI:142853 ! (2R)-glufosinate relationship: has_role CHEBI:24319 ! EC 6.3.1.2 (glutamate--ammonia ligase) inhibitor relationship: has_role CHEBI:24527 ! herbicide [Term] id: CHEBI:52138 name: 4-O-phosphohygromycin B is_a: CHEBI:36974 ! aminoglycoside phosphate is_a: CHEBI:71989 ! ortho ester [Term] id: CHEBI:52142 name: flavonol 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:52143 name: flavonol 3-O-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:52144 name: flavonol 7-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone [Term] id: CHEBI:52157 name: organic heteroheptacyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:52206 name: biochemical role is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52208 name: biophysical role is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52209 name: aetiopathogenetic role is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52210 name: pharmacological role is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52211 name: physiological role is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52214 name: ligand is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:52215 name: photochemical role is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:52216 name: photobiochemical role is_a: CHEBI:52206 ! biochemical role is_a: CHEBI:52215 ! photochemical role [Term] id: CHEBI:52217 name: pharmaceutical is_a: CHEBI:33232 ! application [Term] id: CHEBI:52221 name: isothiocyanate subset: chebi_ph7_3 is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:52222 name: (2R)-homocitric acid is_a: CHEBI:17852 ! homocitric acid [Term] id: CHEBI:52225 name: UDP-2-acetamido-2,6-dideoxy-beta-L-arabino-hex-4-ulose is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:52226 name: epi-cedrol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36745 ! cedrane sesquiterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:52228 name: (3R)-all-trans-3-hydroxyretinal subset: chebi_ph7_3 is_a: CHEBI:26537 ! retinoid [Term] id: CHEBI:52254 name: apatite is_a: CHEBI:46723 ! phosphate mineral [Term] id: CHEBI:52255 name: hydroxylapatite is_a: CHEBI:52254 ! apatite [Term] id: CHEBI:52267 name: 7-hydroxyflavonol subset: chebi_ph7_3 is_a: CHEBI:28802 ! flavonols [Term] id: CHEBI:52268 name: flavonol 3-O-[6-(4-coumaroyl)-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside]s subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:36087 ! cinnamate ester is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:52280 name: isopimara-7,15-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:52283 name: 1D-myo-inositol 2-amino-2-deoxy-alpha-D-glucopyranoside is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:52285 name: 1D-myo-inositol 2-(L-cysteinylamino)-2-deoxy-alpha-D-glucopyranoside is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:52288 name: 1-octadec-9-enoylglycero-3-phosphate is_a: CHEBI:76629 ! 2-lysophosphatidic acid relationship: has_role CHEBI:52290 ! mitogen relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52289 name: wortmannin subset: chebi_ph7_3 is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:132992 ! radiosensitizing agent relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50914 ! EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor relationship: has_role CHEBI:76964 ! Penicillium metabolite relationship: has_role CHEBI:88230 ! autophagy inhibitor [Term] id: CHEBI:52290 name: mitogen is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:52303 name: sterol methyltransferase inhibitor is_a: CHEBI:76871 ! EC 2.1.1.* (methyltransferases) inhibitor [Term] id: CHEBI:52317 name: thalianol subset: chebi_ph7_3 is_a: CHEBI:52340 ! tricyclic triterpenoid [Term] id: CHEBI:52320 name: ergosteryl ester subset: chebi_ph7_3 is_a: CHEBI:131748 ! ergostane ester is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:52322 name: zymosterol ester subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:52323 name: 1,2-dioleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride is_a: CHEBI:75945 ! dioleoylglycerol [Term] id: CHEBI:52324 name: 3-hydroxyicosanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52325 name: 3-hydroxydocosanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52327 name: 3-oxoicosanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52328 name: 3-oxodocosanoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52329 name: 3-oxotetracosanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52330 name: glycerophosphatidylethanolamine is_a: CHEBI:26706 ! sn-glycerol 3-phosphates is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:52333 name: 1,2-dioleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:52323 ! 1,2-dioleoylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:52340 name: tricyclic triterpenoid is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:52342 name: ethyl formate subset: chebi_ph7_3 is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:52343 ! formate ester relationship: has_role CHEBI:39276 ! fumigant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:52343 name: formate ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:52347 name: 3-hydroxyicosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:52348 name: 3-hydroxydocosanoic acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:52350 name: 3-oxoicosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:52351 name: 3-oxodocosanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:52352 name: 3-oxotetracosanoic acid is_a: CHEBI:47881 ! 3-oxo monocarboxylic acid [Term] id: CHEBI:52360 name: 1,2-dioleoyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:52362 name: ortho-fused heteroarene is_a: CHEBI:33637 ! ortho-fused compound is_a: CHEBI:38180 ! polycyclic heteroarene [Term] id: CHEBI:52371 name: N-(2-hydroxytetracosanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52372 name: N-(2-hydroxyhexacosanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52373 name: N-(2-hydroxytetracosanoyl)phytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52374 name: N-(2-hydroxyhexacosanyl)-(4R)-phytosphingosine subset: chebi_ph7_3 is_a: CHEBI:64958 ! N-(2-hydroxyhexacosanoyl)phytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52381 name: hexadec-2-enoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52386 name: zymosterol intermediate 2 subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52388 name: 4-hydroxymethylzymosterol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52392 name: 2-arachidonoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134144 ! 2-acylglycerol 20:4 is_a: CHEBI:67197 ! endocannabinoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52393 name: episterol ester subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:52394 name: lanosteryl ester subset: chebi_ph7_3 is_a: CHEBI:131747 ! lanostane ester is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:52395 name: oxyketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:52396 name: alpha-oxyketone is_a: CHEBI:52395 ! oxyketone [Term] id: CHEBI:52402 name: 2,5-diamino-6-(5-phosphono)ribitylamino-4(3H)-pyrimidinone is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52417 name: D-glucosone subset: chebi_ph7_3 is_a: CHEBI:33921 ! ketoaldohexose [Term] id: CHEBI:52421 name: 3-oxohexacosanoic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid [Term] id: CHEBI:52424 name: EC 3.2.1.* (glycosidase) inhibitor is_a: CHEBI:76761 ! EC 3.2.* (glycosylase) inhibitor [Term] id: CHEBI:52425 name: EC 3.2.1.18 (exo-alpha-sialidase) inhibitor is_a: CHEBI:36044 ! antiviral drug is_a: CHEBI:52424 ! EC 3.2.1.* (glycosidase) inhibitor [Term] id: CHEBI:52426 name: 6-(alpha-D-glucosaminyl)-1D-myo-inositol 1,2-cyclic phosphate is_a: CHEBI:25444 ! myo-inositol cyclic phosphate is_a: CHEBI:35373 ! D-glucosaminide is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:52430 name: N-malonylanthranilic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:52432 name: (24E)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA is_a: CHEBI:27505 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA relationship: has_role CHEBI:48887 ! bile acid metabolite [Term] id: CHEBI:52440 name: cephalosporin carboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:52442 name: 1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:52443 name: 1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside 3-phosphate is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside is_a: CHEBI:84140 ! myo-inositol monophosphate derivative [Term] id: CHEBI:52447 name: tetrahydrodictyopterin subset: chebi_ph7_3 is_a: CHEBI:15372 ! 5,6,7,8-tetrahydrobiopterin relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:52448 name: amino monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:52449 name: 5-oxo-ETE is_a: CHEBI:61704 ! oxoicosatetraenoic acid relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52450 name: 2-O-acetyl-1-O-octadecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36707 ! 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:35530 ! beta-adrenergic antagonist relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:50141 ! bronchoconstrictor agent relationship: has_role CHEBI:50248 ! hematologic agent [Term] id: CHEBI:52461 name: elisabethatriene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:52463 name: fusicocca-2,10(14)-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:52464 name: jasmonate ester is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:52469 name: precorrin-1 is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:52482 name: levopimaradienol subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52483 name: levopimaradienal subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52484 name: isopimara-7,15-dienol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52485 name: isopimara-7,15-dienal subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52486 name: dehydroabietadienol subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52487 name: dehydroabietadienal subset: chebi_ph7_3 is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:52488 name: cobalt-precorrin-5A is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:52489 name: cobalt-precorrin-5B is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:52490 name: cobalt-precorrin-7 is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:52491 name: cobalt-sirohydrochlorin is_a: CHEBI:25216 ! metalloporphyrin [Term] id: CHEBI:52499 name: cob(II)yrinic acid is_a: CHEBI:23389 ! cobalt-corrinoid heptacarboxylic acid is_a: CHEBI:52500 ! cobyrinic acid [Term] id: CHEBI:52500 name: cobyrinic acid is_a: CHEBI:17926 ! hydrogenobyrinic acid is_a: CHEBI:23389 ! cobalt-corrinoid heptacarboxylic acid [Term] id: CHEBI:52501 name: 2-hydroxycarbonyl compound subset: chebi_ph7_3 is_a: CHEBI:36586 ! carbonyl compound [Term] id: CHEBI:52507 name: haloindole is_a: CHEBI:24828 ! indoles [Term] id: CHEBI:52508 name: chloroindole is_a: CHEBI:52507 ! haloindole [Term] id: CHEBI:5254 name: galactolipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:52557 name: tetracyclic diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:52564 name: 2-carboxy-4-methyl-5-[(2-phosphonooxy)ethylidene]-2,5-dihydrothiazole is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38418 ! 1,3-thiazoles is_a: CHEBI:7794 ! phosphate monoester is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:52565 name: acylglycerophosphoserine is_a: CHEBI:35766 ! glycerophosphoserine [Term] id: CHEBI:52567 name: 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate is_a: CHEBI:76170 ! olefinic phospholipid [Term] id: CHEBI:52569 name: 1-(alk-1-enyl)glycerol subset: chebi_ph7_3 is_a: CHEBI:24353 ! glycerol ether is_a: CHEBI:76575 ! monoradylglycerol is_a: CHEBI:77998 ! 1(3)-O-(alk-1-enyl)-glycerol [Term] id: CHEBI:52570 name: alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:140817 ! alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36508 ! glycotriaosylceramide [Term] id: CHEBI:52572 name: acylglucosaminylphosphatidylinositol is_a: CHEBI:24275 ! glucosaminylphosphatidylinositol [Term] id: CHEBI:52575 name: alkylglycerol is_a: CHEBI:24353 ! glycerol ether [Term] id: CHEBI:52582 name: isobacteriochlorins is_a: CHEBI:26214 ! porphyrins [Term] id: CHEBI:52592 name: N-retinylidene-N-retinylphosphatidylethanolamine is_a: CHEBI:26537 ! retinoid is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:52595 name: 1-alkyl-2-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:144315 ! 1-radyl-2-acyl-sn-glycerolipid is_a: CHEBI:598 ! 1-alkyl-2-acylglycerol is_a: CHEBI:76582 ! monoalkylmonoacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52602 name: ganglioside GP1c is_a: CHEBI:36543 ! sialotetraosylceramide [Term] id: CHEBI:52603 name: 1-acyl-sn-glycero-3-phosphoserine is_a: CHEBI:68510 ! lysophosphatidylserine [Term] id: CHEBI:52615 name: 4-formylzymosterol subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52617 name: 7,8-dihydro-8-oxoguanine subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine [Term] id: CHEBI:52618 name: 2-hydroxy carboxylic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid [Term] id: CHEBI:52625 name: inorganic hydroxy compound is_a: CHEBI:24651 ! hydroxides is_a: CHEBI:24835 ! inorganic molecular entity [Term] id: CHEBI:52629 name: EC 3.1.26.13 (retroviral ribonuclease H) inhibitor is_a: CHEBI:64947 ! anti-HIV-1 agent is_a: CHEBI:76785 ! EC 3.1.26.* (endoribonucleases producing 5'-phosphomonoesters) inhibitor [Term] id: CHEBI:52639 name: N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:82830 ! sphingosine-based sphingolipid is_a: CHEBI:83273 ! N-acylsphingoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52640 name: N-acylethanolamine subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23981 ! ethanolamines [Term] id: CHEBI:52641 name: polyphosphoric acid is_a: CHEBI:33457 ! phosphorus oxoacid is_a: CHEBI:37786 ! acyclic phosphorus acid anhydride [Term] id: CHEBI:52646 name: leptomycin B is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:52651 ! leptomycin relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:52648 name: N(beta)-acyl-L-2,3-diaminopropionic acid is_a: CHEBI:21644 ! N-acyl-L-amino acid [Term] id: CHEBI:52649 name: 1-O-oleoyl-sn-glycero-3-phosphoserine is_a: CHEBI:52603 ! 1-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:52651 name: leptomycin is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:25000 ! lactone is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid is_a: CHEBI:59644 ! oxo fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:52656 name: O-acyltropine subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:52657 name: O-acylpseudotropine subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:52668 name: 1,4-dihydroxy-2-naphthoyl-CoA is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:51475 ! naphthohydroquinone relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:52669 name: 2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoic acid is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:35871 ! oxo monocarboxylic acid [Term] id: CHEBI:52678 name: 3-methoxyphenol subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:52679 name: 5-alkylresorcinol subset: chebi_ph7_3 is_a: CHEBI:33572 ! resorcinols [Term] id: CHEBI:52680 name: 5-(pentadeca-8,11,14-trien-1-yl)resorcinol subset: chebi_ph7_3 is_a: CHEBI:52731 ! 5-alkatrienylresorcinol [Term] id: CHEBI:52681 name: 5-(pentadeca-8,11,14-trien-1-yl)resorcinol monomethyl ether subset: chebi_ph7_3 is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:52682 name: butane-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:52684 ! butanediol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:52684 name: butanediol is_a: CHEBI:22944 ! butanediols [Term] id: CHEBI:52726 name: proteasome inhibitor is_a: CHEBI:23888 ! drug [Term] id: CHEBI:52731 name: 5-alkatrienylresorcinol subset: chebi_ph7_3 is_a: CHEBI:33572 ! resorcinols [Term] id: CHEBI:52742 name: D-ribofuranose 5-phosphate is_a: CHEBI:78679 ! D-ribose 5-phosphate [Term] id: CHEBI:52773 name: alpha-D-glucosiduronic acid is_a: CHEBI:24302 ! glucosiduronic acid [Term] id: CHEBI:52775 name: UDP-N-acetyl-2-amino-2-deoxy-D-glucuronic acid is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:52782 name: O-acyl carbohydrate is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:52785 name: 2-(E)-O-feruloyl-D-galactaric acid is_a: CHEBI:16590 ! O-feruloylgalactaric acid [Term] id: CHEBI:52794 name: beta-L-aspartylhydroxamic acid is_a: CHEBI:24650 ! hydroxamic acid is_a: CHEBI:52987 ! L-asparagine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:52831 name: Delta(11)-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:52837 name: quinolinium ion is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:52845 name: cyclic organic group is_a: CHEBI:33247 ! organic group [Term] id: CHEBI:52857 name: S-sulfanylglutathione is_a: CHEBI:17021 ! S-substituted glutathione is_a: CHEBI:47923 ! tripeptide is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:52859 name: choline hydrogen sulfate is_a: CHEBI:23216 ! choline sulfates is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:528881 name: (9Z,12Z,15Z)-octadeca-9,12,15-trienoate is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:52897 name: sphingosylphosphocholine acid is_a: CHEBI:35267 ! quaternary ammonium ion is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36700 ! phosphocholines [Term] id: CHEBI:52961 name: N-tetracosanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:86265 ! N-(1,2-saturated acyl)sphinganine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52962 name: N-hexacosanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:137574 ! Cer(d44:0) is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:31488 ! N-acylsphinganine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52966 name: hexacosanoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52970 name: ubiquinol-6 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol is_a: CHEBI:26253 ! polyprenylhydroquinone relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52971 name: ubiquinone-6 subset: chebi_ph7_3 is_a: CHEBI:16389 ! ubiquinones relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52972 name: ergosta-5,7,24(28)-trien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:138131 ! Delta(5),Delta(7)-sterol is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52973 name: ergosteryl 3-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52974 name: tetracosanoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52975 name: trans-2-hexacosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52977 name: 3-oxohexacosanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:52979 name: N-tetracosanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:31998 ! N-acylphytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52980 name: N-hexacosanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:31998 ! N-acylphytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:52984 name: trans-2-hexacosenoic acid is_a: CHEBI:52985 ! 2-hexacosenoic acid [Term] id: CHEBI:52985 name: 2-hexacosenoic acid is_a: CHEBI:78865 ! hexacosenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:52987 name: L-asparagine derivative is_a: CHEBI:22654 ! asparagine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:52994 name: precursor Z is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:52996 name: alpha-D-glucosyl-(1->3)-D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:52997 ! D-glucopyranosyl-(1->3)-D-mannopyranose [Term] id: CHEBI:52997 name: D-glucopyranosyl-(1->3)-D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:21010 ! D-glucosyl-D-mannose [Term] id: CHEBI:53 name: (+)-beta-phellandrene subset: chebi_ph7_3 is_a: CHEBI:48741 ! beta-phellandrene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:53000 name: epitope is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:53010 name: nucleoside 2'-phosphate is_a: CHEBI:29075 ! mononucleotide [Term] id: CHEBI:53012 name: xanthosine 5'-phosphate is_a: CHEBI:27329 ! xanthosine phosphate [Term] id: CHEBI:53013 name: 3'-CMP is_a: CHEBI:23518 ! cytidine 3'-phosphate is_a: CHEBI:37018 ! pyrimidine ribonucleoside 3'-monophosphate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:53025 name: L-galactose 1-phosphate is_a: CHEBI:20960 ! galactose phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:53028 name: 4-deoxy-4-formamido-alpha-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:53030 name: oxysterol is_a: CHEBI:15889 ! sterol [Term] id: CHEBI:53039 name: tetradecaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53040 name: tridecaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53041 name: dodecaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53042 name: undecaprenyl diphosphate is_a: CHEBI:27193 ! undecaprenyl phosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53043 name: decaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53044 name: nonaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53045 name: octaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53046 name: heptaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53047 name: hexaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53048 name: pentaprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:53071 name: L-galactonate subset: chebi_ph7_3 is_a: CHEBI:24148 ! galactonate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:53072 name: beta-L-galactose 1-phosphate is_a: CHEBI:53025 ! L-galactose 1-phosphate [Term] id: CHEBI:53079 name: lysine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:53081 name: prostaglandin F2alpha 1-ethanolamide subset: chebi_ph7_3 is_a: CHEBI:36066 ! prostaglandins Falpha is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:53082 name: prostaglandin H2 1-ethanolamide subset: chebi_ph7_3 is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:53091 name: carbodiimide is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:53100 name: GMP 5'-end residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:53112 name: AMP 3'-end residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:53121 name: adenosine A2A receptor antagonist is_a: CHEBI:71232 ! adenosine receptor antagonist [Term] id: CHEBI:53125 name: Se-methyl-D-selenocysteine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:9068 ! Se-methylselenocysteine [Term] id: CHEBI:53126 name: Se-methyl-L-selenocysteinate is_a: CHEBI:53128 ! Se-methylselenocysteinate [Term] id: CHEBI:53128 name: Se-methylselenocysteinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:53129 name: Se-methyl-D-selenocysteinate is_a: CHEBI:53128 ! Se-methylselenocysteinate [Term] id: CHEBI:53130 name: Se-methyl-L-selenocysteinium is_a: CHEBI:53132 ! Se-methylselenocysteinium [Term] id: CHEBI:53131 name: Se-methyl-D-selenocysteinium is_a: CHEBI:53132 ! Se-methylselenocysteinium [Term] id: CHEBI:53132 name: Se-methylselenocysteinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:53146 name: (2Z,4E)-2-hydroxymuconic acid is_a: CHEBI:24553 ! hexadienedioic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:53152 name: palmitoleoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:53153 name: 10'-apo-beta-carotenal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53154 name: 8'-apo-beta,psi-caroten-8'-al subset: chebi_ph7_3 is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:53155 name: 2,6-dimethylocta-2,4,6-trienedial subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:49247 ! apo carotenoid monoterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:53156 name: polychlorobiphenyl is_a: CHEBI:134045 ! polychlorinated dibenzodioxines and related compounds is_a: CHEBI:35446 ! chlorobiphenyl relationship: has_role CHEBI:138015 ! endocrine disruptor relationship: has_role CHEBI:77853 ! persistent organic pollutant [Term] id: CHEBI:53157 name: 4'-apo-beta-carotenal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal is_a: CHEBI:53185 ! apo carotenoid C35 terpenoid [Term] id: CHEBI:53159 name: (3R)-3-hydroxy-8'-apo-beta-carotenal subset: chebi_ph7_3 is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:53166 name: crocetin dialdehyde subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal is_a: CHEBI:53186 ! apo carotenoid diterpenoid [Term] id: CHEBI:53167 name: hydroxy-beta-cyclocitral subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid [Term] id: CHEBI:53171 name: 4,9-dimethyldodeca-2,4,6,8,10-pentaenedial subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53173 name: (3R)-hydroxy-beta-ionone subset: chebi_ph7_3 is_a: CHEBI:49247 ! apo carotenoid monoterpenoid [Term] id: CHEBI:53175 name: 13-apo-beta-carotenone subset: chebi_ph7_3 is_a: CHEBI:51689 ! enone is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53176 name: 4-methylocta-2,4,6-trienedial subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53177 name: beta-cyclocitral subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:53183 name: apo carotenoid is_a: CHEBI:24913 ! isoprenoid [Term] id: CHEBI:53185 name: apo carotenoid C35 terpenoid is_a: CHEBI:51961 ! sesquarterpenoid is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53186 name: apo carotenoid diterpenoid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:53210 name: O-propanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:28867 ! O-propanoylcarnitine relationship: has_role CHEBI:49110 ! peripheral nervous system drug [Term] id: CHEBI:53224 name: poly(amide) macromolecule is_a: CHEBI:32988 ! amide is_a: CHEBI:33839 ! macromolecule [Term] id: CHEBI:53225 name: poly(alkylene) macromolecule is_a: CHEBI:37997 ! homopolymer macromolecule [Term] id: CHEBI:53226 name: polyethylene macromolecule is_a: CHEBI:53225 ! poly(alkylene) macromolecule [Term] id: CHEBI:53242 name: vinyl polymer macromolecule subset: chebi_ph7_3 is_a: CHEBI:53226 ! polyethylene macromolecule [Term] id: CHEBI:53259 name: poly(ethylene terephthalate) macromolecule subset: chebi_ph7_3 is_a: CHEBI:26178 ! polyester macromolecule [Term] id: CHEBI:53291 name: 2-halophenol subset: chebi_ph7_3 is_a: CHEBI:38856 ! halophenol [Term] id: CHEBI:533015 name: 3,3',5-triiodo-L-thyronine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:53309 name: polyanionic macromolecule is_a: CHEBI:33839 ! macromolecule is_a: CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:53310 name: copolymer macromolecule is_a: CHEBI:33839 ! macromolecule [Term] id: CHEBI:53335 name: (S)-3-hydroxy-3-methyl-2-oxopentanoic acid is_a: CHEBI:28710 ! 3-hydroxy-3-methyl-2-oxopentanoic acid [Term] id: CHEBI:53338 name: 3-hydroxy-3-methyl-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion [Term] id: CHEBI:53339 name: olefinic fatty acid is_a: CHEBI:27208 ! unsaturated fatty acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:53348 name: benzenesulfonates is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:53353 name: GHB receptor agonist is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:53368 name: ionic macromolecule is_a: CHEBI:33839 ! macromolecule [Term] id: CHEBI:5337 name: (1E,4E)-germacrene B subset: chebi_ph7_3 is_a: CHEBI:49314 ! germacrene B [Term] id: CHEBI:53373 name: gamma-poly(glutamic acid) macromolecule is_a: CHEBI:37997 ! homopolymer macromolecule is_a: CHEBI:53224 ! poly(amide) macromolecule [Term] id: CHEBI:53376 name: gamma-poly(glutamate) macromolecule is_a: CHEBI:53224 ! poly(amide) macromolecule is_a: CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:53387 name: poly(hydroxyalkanoate) is_a: CHEBI:26178 ! polyester macromolecule [Term] id: CHEBI:53388 name: poly(hydroxybutyrate) is_a: CHEBI:53387 ! poly(hydroxyalkanoate) [Term] id: CHEBI:53390 name: poly(hydroxyvalerate) is_a: CHEBI:53387 ! poly(hydroxyalkanoate) [Term] id: CHEBI:53391 name: poly(3-hydroxyvalerate) subset: chebi_ph7_3 is_a: CHEBI:53390 ! poly(hydroxyvalerate) [Term] id: CHEBI:53392 name: poly(5-hydroxyvalerate) subset: chebi_ph7_3 is_a: CHEBI:53390 ! poly(hydroxyvalerate) [Term] id: CHEBI:53404 name: poly(alkylene vinylene) macromolecule subset: chebi_ph7_3 is_a: CHEBI:37997 ! homopolymer macromolecule [Term] id: CHEBI:53405 name: poly(isoprene) macromolecule subset: chebi_ph7_3 is_a: CHEBI:53404 ! poly(alkylene vinylene) macromolecule [Term] id: CHEBI:53406 name: cis-1,4-polyisoprene subset: chebi_ph7_3 is_a: CHEBI:53405 ! poly(isoprene) macromolecule [Term] id: CHEBI:53431 name: chain carrier is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:53455 name: D-xylopyranose subset: chebi_ph7_3 is_a: CHEBI:65327 ! D-xylose [Term] id: CHEBI:53460 name: all-cis-icosa-11,14,17-trienoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:36036 ! fatty acid 20:3 [Term] id: CHEBI:53463 name: heptasaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:53486 name: all-cis-icosa-8,11,14-trienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:36036 ! fatty acid 20:3 relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:53487 name: all-cis-docosa-7,10,13,16-tetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:61205 ! docosatetraenoic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:53488 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:61204 ! docosapentaenoic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:53508 name: thyroxine sulfate is_a: CHEBI:24864 ! iodothyronine [Term] id: CHEBI:53604 name: O-(N-acetyl-alpha-D-galactosaminyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:53608 name: O-(N-acetyl-alpha-D-galactosaminyl)-L-serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:144829 ! tumour antigen [Term] id: CHEBI:53609 name: O-(N-acetyl-alpha-D-galactosaminyl)-L-threonine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84189 ! L-threonine derivative relationship: has_role CHEBI:144829 ! tumour antigen [Term] id: CHEBI:53628 name: 2,6-dideoxy-alpha-D-glucoside is_a: CHEBI:22390 ! alpha-D-glucoside [Term] id: CHEBI:53634 name: neomycin C is_a: CHEBI:47779 ! aminoglycoside [Term] id: CHEBI:53643 name: phyllocladan-16alpha-ol subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene is_a: CHEBI:53666 ! kaurane diterpenoid [Term] id: CHEBI:53647 name: dehydroglycine is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:24783 ! imine relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:53650 name: guaiacylglycerol-beta-guaiacyl ether subset: chebi_ph7_3 is_a: CHEBI:24353 ! glycerol ether [Term] id: CHEBI:53659 name: EC 1.4.3.22 (diamine oxidase) inhibitor is_a: CHEBI:76861 ! EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor [Term] id: CHEBI:53664 name: dehydroglycinate is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:53666 name: kaurane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:53680 name: dihalogenated L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:33856 ! aromatic amino acid [Term] id: CHEBI:5373 name: (S)-glaucine is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:46774 ! polyether is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:51177 ! antitussive relationship: has_role CHEBI:51371 ! muscle relaxant relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:53746 name: EC 1.1.1.205 (IMP dehydrogenase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:537519 name: L-aspartic acid 4-semialdehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:53753 name: triolein subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:53756 name: HIV-1 reverse transcriptase inhibitor is_a: CHEBI:52629 ! EC 3.1.26.13 (retroviral ribonuclease H) inhibitor is_a: CHEBI:64947 ! anti-HIV-1 agent [Term] id: CHEBI:53784 name: antispasmodic drug is_a: CHEBI:51371 ! muscle relaxant [Term] id: CHEBI:53794 name: (4-hydroxy-3-nitrophenyl)acetate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:53800 name: 4-hydroxy-2-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:5385 name: gliotoxin subset: chebi_ph7_3 is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:64130 ! pyrazinoindole relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:52726 ! proteasome inhibitor relationship: has_role CHEBI:64133 ! EC 2.5.1.58 (protein farnesyltransferase) inhibitor [Term] id: CHEBI:5386 name: globin is_a: CHEBI:35137 ! hemoprotein [Term] id: CHEBI:5391 name: glucagon is_a: CHEBI:25905 ! peptide hormone [Term] id: CHEBI:5411 name: gluconapin(1-) subset: chebi_ph7_3 is_a: CHEBI:36451 ! alkenylglucosinolate [Term] id: CHEBI:5417 name: glucosamine is_a: CHEBI:24271 ! glucosamines [Term] id: CHEBI:541975 name: epiandrosterone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:5435 name: piperidine-2,6-dione subset: chebi_ph7_3 is_a: CHEBI:35356 ! dicarboximide is_a: CHEBI:48589 ! piperidones [Term] id: CHEBI:543745 name: 3',4',5'-O-trimethyltricetin is_a: CHEBI:138732 ! 3',5'-dimethoxyflavone is_a: CHEBI:27124 ! trimethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone [Term] id: CHEBI:5445 name: glyceraldehyde subset: chebi_ph7_3 is_a: CHEBI:33914 ! aldotriose relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:545687 name: traumatic acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:37848 ! plant hormone [Term] id: CHEBI:5457 name: glycerophosphoglycerol is_a: CHEBI:24360 ! glycerophosphoglycerols [Term] id: CHEBI:546274 name: (4-hydroxy-3-nitrophenyl)acetic acid is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:59174 ! hapten [Term] id: CHEBI:546807 name: beta-D-Galp-(1->3)-D-GalpNAc subset: chebi_ph7_3 is_a: CHEBI:146500 ! D-Galp-(1->3)-D-GalpNAc is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22484 ! galactosamine oligosaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:546808 name: alpha-D-Gal-(1->4)-D-Gal subset: chebi_ph7_3 is_a: CHEBI:35317 ! glycosylgalactose [Term] id: CHEBI:5530 name: gramicidin S is_a: CHEBI:24613 ! homodetic cyclic peptide [Term] id: CHEBI:55310 name: poly(2,5-ethylene furandicarboxylate) subset: chebi_ph7_3 is_a: CHEBI:26178 ! polyester macromolecule [Term] id: CHEBI:55322 name: mu-opioid receptor agonist is_a: CHEBI:60599 ! mu-opioid agent is_a: CHEBI:60606 ! opioid receptor agonist [Term] id: CHEBI:55323 name: antidiarrhoeal drug is_a: CHEBI:55324 ! gastrointestinal drug [Term] id: CHEBI:55324 name: gastrointestinal drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:55327 name: aci-nitroethane(1-) is_a: CHEBI:33458 ! nitrogen oxoanion [Term] id: CHEBI:55328 name: 16-hydroxyhexadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:72726 ! hydroxypalmitic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:55329 name: 16-hydroxyhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:5533 name: granaticin subset: chebi_ph7_3 is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:48129 ! benzoisochromanequinone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:55330 name: 16-feruloyloxypalmitic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:55331 name: 16-feruloyloxypalmitate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:55332 name: beta-D-galactosyl-(1->4)-L-rhamnose subset: chebi_ph7_3 is_a: CHEBI:55333 ! glycosylrhamnose [Term] id: CHEBI:55333 name: glycosylrhamnose is_a: CHEBI:36233 ! disaccharide [Term] id: CHEBI:55334 name: delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:55335 name: ternatin C5 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:55336 name: delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside-3'-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:55337 name: all-trans-polyprenyl diphosphate is_a: CHEBI:37531 ! polyprenyl diphosphate [Term] id: CHEBI:55353 name: (2E)-but-2-ene-1,2,3-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:55354 name: 7-chlorotryptophan is_a: CHEBI:27164 ! tryptophan derivative is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:52508 ! chloroindole is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:55355 name: 7-chloro-D-tryptophan is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:47997 ! D-tryptophan derivative is_a: CHEBI:55354 ! 7-chlorotryptophan [Term] id: CHEBI:55356 name: (R)-piperazine-2-carboxamide is_a: CHEBI:46853 ! piperazinecarboxamide [Term] id: CHEBI:55357 name: (R)-piperazine-2-carboxylic acid is_a: CHEBI:48683 ! piperazinecarboxylic acid [Term] id: CHEBI:55358 name: (R)-piperazine-2-carboxylate is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:55359 name: (R)-N-tert-butylpiperazine-2-carboxamide is_a: CHEBI:46853 ! piperazinecarboxamide [Term] id: CHEBI:55360 name: beta-alaninamide is_a: CHEBI:22475 ! amino acid amide [Term] id: CHEBI:55366 name: ribonucleotide residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:55367 name: deoxyribonucleotide residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:55370 name: imidazolidinone is_a: CHEBI:38261 ! imidazolidines [Term] id: CHEBI:55373 name: isoxazoles is_a: CHEBI:35790 ! oxazole [Term] id: CHEBI:55376 name: ferriheme b(1-) subset: chebi_ph7_3 is_a: CHEBI:26355 ! heme b [Term] id: CHEBI:55377 name: beta-hematin subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:55380 name: beta-hydroxy ketone is_a: CHEBI:17087 ! ketone relationship: has_part CHEBI:43176 ! hydroxy group [Term] id: CHEBI:55390 name: dicarbide(1-) is_a: CHEBI:38222 ! hydrocarbyl anion [Term] id: CHEBI:55391 name: (S)-piperazine-2-carboxamide is_a: CHEBI:46853 ! piperazinecarboxamide [Term] id: CHEBI:55392 name: (S)-piperazine-2-carboxylic acid is_a: CHEBI:48683 ! piperazinecarboxylic acid [Term] id: CHEBI:55393 name: (S)-piperazine-2-carboxylate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:55396 name: 2-dehydropyranose is_a: CHEBI:33921 ! ketoaldohexose [Term] id: CHEBI:55399 name: L-aminoacyl-L-amino acid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:55400 name: 3-dehydropyranose is_a: CHEBI:33921 ! ketoaldohexose [Term] id: CHEBI:55402 name: 3-dehydro-D-glucose subset: chebi_ph7_3 is_a: CHEBI:55400 ! 3-dehydropyranose [Term] id: CHEBI:55404 name: N-acetyl-D-galactosamine 1-phosphate is_a: CHEBI:28207 ! D-galactosamine 1-phosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:55406 name: beta-D-apiofuranosyl-(1->6)-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:55409 name: 6-iminocyclohexa-2,4-dienone subset: chebi_ph7_3 is_a: CHEBI:50193 ! quinone imine [Term] id: CHEBI:55410 name: anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside) is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:55412 name: N-acyl-L-homoserine is_a: CHEBI:55414 ! N-acylhomoserine [Term] id: CHEBI:55414 name: N-acylhomoserine is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:55415 name: N-acyl-D-homoserine is_a: CHEBI:55414 ! N-acylhomoserine [Term] id: CHEBI:55417 name: maleimides is_a: CHEBI:35356 ! dicarboximide [Term] id: CHEBI:55429 name: cephamycin is_a: CHEBI:38311 ! cephem [Term] id: CHEBI:55430 name: 1-O-hexadecyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:28894 ! 1-O-alkyl-2-O-arachidonoyl-sn-glycero-3-phosphocholine is_a: CHEBI:67064 ! phosphatidylcholine O-36:4 [Term] id: CHEBI:55435 name: beta-Asp-Arg is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:55436 name: 2-arylethylamine is_a: CHEBI:32877 ! primary amine [Term] id: CHEBI:55437 name: 2-demethylmenaquinol subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:55438 name: Ile(5)-angiotensin II (1-7) is_a: CHEBI:48433 ! angiotensin relationship: has_role CHEBI:35620 ! vasodilator agent [Term] id: CHEBI:55451 name: lipoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride is_a: CHEBI:39192 ! dithiolanes relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:55455 name: delphinidin 3-O-beta-D-glucoside-5-O-beta-D-glucoside is_a: CHEBI:140278 ! 5-hydroxyanthocyanin O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:55456 name: delphinidin 3,3',5-tri-O-glucoside is_a: CHEBI:140278 ! 5-hydroxyanthocyanin O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:55458 name: 1-(beta-D-ribofuranosyl)-1,4-dihydronicotinamide subset: chebi_ph7_3 is_a: CHEBI:47896 ! pyridine nucleoside is_a: CHEBI:50075 ! dihydropyridine [Term] id: CHEBI:55464 name: 7-[beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]isoflavone is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:55465 name: 7-hydroxyisoflavones subset: chebi_ph7_3 is_a: CHEBI:38755 ! hydroxyisoflavone [Term] id: CHEBI:55467 name: dalpatein beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:55464 ! 7-[beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]isoflavone [Term] id: CHEBI:55469 name: N-acetyl-2-arylethylamine subset: chebi_ph7_3 is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:55474 name: N-acyl-L-homoserine lactone subset: chebi_ph7_3 is_a: CHEBI:83169 ! N-acyl homoserine lactone [Term] id: CHEBI:55476 name: N-formyl-D-kynurenine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:24079 ! formamides [Term] id: CHEBI:55478 name: beta-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-Glu-N(6)-(beta-D-Asp)-L-Lys-(D-Ala)2 is_a: CHEBI:17149 ! N-acetyl-beta-D-glycosaminyl glycopeptide [Term] id: CHEBI:55479 name: cis-3-hydroxy-L-proline is_a: CHEBI:20056 ! 3-hydroxy-L-proline [Term] id: CHEBI:55484 name: alpha-phenylglycine is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:55485 name: dermatan 6'-sulfate is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37395 ! mucopolysaccharide [Term] id: CHEBI:55491 name: glycerol 1-phosphodiester is_a: CHEBI:25703 ! organic phosphate [Term] id: CHEBI:55493 name: 1-O-acylglycerophosphoethanolamine is_a: CHEBI:64574 ! lysophosphatidylethanolamine [Term] id: CHEBI:55505 name: 1,2-benzisothiazole is_a: CHEBI:37947 ! benzothiazoles [Term] id: CHEBI:55513 name: 2-deoxy-D-ribofuranose 5-phosphate is_a: CHEBI:16132 ! 2-deoxy-D-ribose 5-phosphate [Term] id: CHEBI:55514 name: laminaritriose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:55517 name: trichothecene subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:32955 ! epoxide is_a: CHEBI:38166 ! organic heteropolycyclic compound relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:55534 name: (R)-2-hydroxy-4-methylpentanoic acid is_a: CHEBI:17893 ! (2R)-2-hydroxy monocarboxylic acid is_a: CHEBI:59783 ! 2-hydroxy-4-methylvaleric acid [Term] id: CHEBI:55535 name: (R)-2-hydroxy-4-methylpentanoate subset: chebi_ph7_3 is_a: CHEBI:133577 ! 2-hydroxy-4-methylvalerate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:55549 name: dalpatein is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:38756 ! methoxyisoflavone is_a: CHEBI:55465 ! 7-hydroxyisoflavones [Term] id: CHEBI:55550 name: dalnigrein beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55464 ! 7-[beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]isoflavone [Term] id: CHEBI:55551 name: dalnigrein is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones [Term] id: CHEBI:55552 name: thymidine 3'-monophosphate is_a: CHEBI:27001 ! thymidine phosphate is_a: CHEBI:36994 ! pyrimidine 2'-deoxyribonucleoside 3'-monophosphate [Term] id: CHEBI:5580 name: gypsogenin is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26606 ! sapogenin [Term] id: CHEBI:5587 name: sulfurothioic S-acid is_a: CHEBI:33540 ! thiosulfuric acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:5610 name: haloalkene is_a: CHEBI:24472 ! halohydrocarbon [Term] id: CHEBI:5613 name: haloperidol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:48590 ! hydroxypiperidine is_a: CHEBI:76224 ! aromatic ketone is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:50919 ! antiemetic relationship: has_role CHEBI:65190 ! first generation antipsychotic relationship: has_role CHEBI:66956 ! antidyskinesia agent [Term] id: CHEBI:5653 name: hemiacetal is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:566274 name: malonaldehyde subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:566789 name: ethylaminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:566825 name: propan-1-aminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:5672 name: heptan-2-one subset: chebi_ph7_3 is_a: CHEBI:18044 ! dialkyl ketone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:5686 name: heterocyclic compound is_a: CHEBI:33595 ! cyclic compound [Term] id: CHEBI:569624 name: papulacandin B subset: chebi_ph7_3 is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:72596 ! papulacandin relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:5697 name: palmitoyl-[acyl-carrier protein] subset: chebi_ph7_3 is_a: CHEBI:16018 ! acyl-[acyl-carrier protein] relationship: has_part CHEBI:45021 ! palmitoyl group relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57248 name: echinocandin is_a: CHEBI:46895 ! lipopeptide is_a: CHEBI:86478 ! antibiotic antifungal agent [Term] id: CHEBI:57251 name: (3S)-3-hydroxy-L-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57252 name: (E)-cinnamoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57253 name: (R)-2-benzylsuccinyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57254 name: (R)-phenyllactoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57255 name: 5-(2-carboxylatoethyl)-4-oxo-4,5-dihydro-1H-imidazol-5-ide is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57257 name: 1L-myo-inositol 1,2,3,4,6-pentakisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:57258 name: 2-amino-5-formylamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:24079 ! formamides is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57259 name: 2-deoxy-alpha-D-ribose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57260 name: 2-methylbut-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57261 name: 3,3',5'-triiodo-L-thyronine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57262 name: 3-sn-phosphatidyl-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:57263 name: 4-carboxylatomethylenebut-2-en-4-olide subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57264 name: 4-fluoro-L-threonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57265 name: 6-(N-acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:143815 ! N-acetyl-alpha-D-glucosaminyl-(1->6)-(phosphatidyl)-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol(1-) is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57266 name: (-)-usnic acid(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57267 name: beta-D-fructofuranose 2-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57268 name: beta-L-fucose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57269 name: N,N'-diacetylchitobiosyldiphosphonatodolichol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57270 name: N,N-dihydroxy-L-tyrosinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:57271 name: indol-3-ylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57273 name: GDP-beta-L-fucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57274 name: 3,5-dibromo-4-oxidobenzoate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:57275 name: dTDP-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57276 name: feruloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57277 name: 3-(3-hydroxyphenyl)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:57278 name: 3-acylpyruvate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:57279 name: 3-ammonio-2-oxopropyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57280 name: N(6)-lipoyl-L-lysinium(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:57281 name: N(6)-(S(8)-ammoniomethyldihydrolipoyl)-L-lysinium(2+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:57283 name: N(alpha)-methyl-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:86139 ! N-methyl-L-alpha-amino acid zwitterion [Term] id: CHEBI:57284 name: 5-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57286 name: acetoacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:90726 ! 3-oxoacyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57287 name: coenzyme A(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57288 name: acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57289 name: blasticidin S(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion is_a: CHEBI:86478 ! antibiotic antifungal agent [Term] id: CHEBI:57290 name: hydroxyacetone phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57291 name: 3-oxopristanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57292 name: succinyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57293 name: (+)-bornyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57294 name: (+)-dihydrokaempferol 7-oxoanion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57295 name: (-)-ephedrinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57296 name: (-)-ureidoglycolate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57297 name: ent-kaur-16-en-19-oate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57298 name: ent-7alpha-hydroxykaur-16-en-19-oate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57299 name: ATP(3-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57300 name: clavaminic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57301 name: dihydroclavaminic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57302 name: proclavaminic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57303 name: deoxyamidinoproclavaminic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57304 name: N(2)-(2-carboxyethyl)-L-arginine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57305 name: glycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57306 name: protoporphyrin(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:57307 name: protoporphyrinogen(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57308 name: uroporphyrinogen III(8-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion is_a: CHEBI:63068 ! octacarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57309 name: coproporphyrinogen III(4-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57310 name: presqualene diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57311 name: (1-hydroxycyclohexyl)acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57312 name: (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57313 name: (2R)-2-methylacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183510 ! 2-methylacyl-CoA(4-) [Term] id: CHEBI:57314 name: (2S)-2-methylacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183510 ! 2-methylacyl-CoA(4-) [Term] id: CHEBI:57315 name: (R)-3-hydroxybutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138609 ! short-chain (R)-3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57316 name: (S)-3-hydroxybutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136760 ! short-chain (3S)-hydroxy fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57317 name: (3S)-3-carboxy-3-hydroxypropanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:136881 ! 3-carboxy-3-hydroxypropanoyl-CoA(5-) [Term] id: CHEBI:57318 name: (S)-3-hydroxyacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:57319 name: (R)-3-hydroxyacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:57320 name: citramalyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57321 name: (3S)-citryl-CoA(6-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57322 name: trans-tetradec-11-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:57323 name: cis-tetradec-11-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:57324 name: cinnamoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57325 name: (E,E)-piperonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57326 name: (R)-methylmalonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57327 name: (S)-methylmalonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57328 name: 3'-dephospho-CoA(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57329 name: 2,4-dichlorobenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57330 name: trans-dodec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83726 ! medium-chain 2,3-trans-enoyl CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57331 name: anthraniloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57332 name: crotonoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57333 name: 2-furoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57334 name: 2-hydroxyphytanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57335 name: 2-methylacetoacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57336 name: 2-methylbutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57337 name: 2-methylcrotonoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57260 ! 2-methylbut-2-enoyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57338 name: isobutyryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57339 name: 3-(4-methylpent-3-en-1-yl)pent-2-enedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57340 name: 3-hydroxy-2-methylpropanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57341 name: 3-hydroxy-3-(4-methylpent-3-en-1-yl)glutaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:57342 name: 3-hydroxybenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57343 name: 3-hydroxypimeloyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:57344 name: 3-methylbut-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57345 name: isovaleryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57346 name: trans-3-methylglutaconyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57347 name: 3-oxo-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:90726 ! 3-oxoacyl-CoA(4-) [Term] id: CHEBI:57348 name: 3-oxoadipyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57349 name: 3-oxopalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57350 name: 3-oxopimeloyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57351 name: 4,8,12-trimethyltridecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57352 name: 4-aminobutanoyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57353 name: trans-4-carboxybut-2-enoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57354 name: 4-chlorobenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57355 name: 4-coumaroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57356 name: 4-hydroxybenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57357 name: 5-hydroxypentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57358 name: 5-hydroxythiophene-2-carbonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57359 name: 2,3-didehydropimeloyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57360 name: pimeloyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57361 name: 6-hydroxycyclohex-1-ene-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57362 name: beta-alanyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57363 name: gamma-linolenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139563 ! octadecatrienoyl-CoA(4-) is_a: CHEBI:76187 ! gamma-linolenoyl bioconjugate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57364 name: 4-(2-carboxyphenyl)-4-oxobutanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57365 name: 5-hydroxy-2-furoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57366 name: L-3-aminobutanoyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:57367 name: acryloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57368 name: arachidonoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57369 name: benzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57370 name: biotinyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57371 name: butyryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57372 name: caffeoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57373 name: choloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138842 ! 3alpha-hydroxy bile acid CoA thioester(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57374 name: cyclohexa-1,5-diene-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57375 name: lauroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57376 name: formyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57377 name: cis-geranoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57378 name: glutaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57379 name: palmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57380 name: icosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:57381 name: itaconyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57382 name: lactoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57383 name: linoleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) [Term] id: CHEBI:57384 name: malonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57385 name: myristoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57386 name: octanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57387 name: oleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57388 name: oxalyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) [Term] id: CHEBI:57389 name: pentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57390 name: phenylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57391 name: phytanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:83968 ! 3-methyl fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57392 name: propionyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:137040 ! short chain fatty acyl-CoA(4-) is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57393 name: sinapoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57394 name: stearoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57395 name: thiophene-2-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57396 name: vinylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:57397 name: prostaglandin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57398 name: prostaglandin A1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57399 name: prostaglandin C1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57400 name: 15-dehydro-prostaglandin E2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:57401 name: 15-dehydro-prostaglandin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57402 name: 13,14-dihydro-15-oxo-prostaglandin E2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:57403 name: prostaglandin I2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57404 name: prostaglandin F2alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57405 name: prostaglandin H2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion is_a: CHEBI:62933 ! oxylipin anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57406 name: prostaglandin D2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57407 name: 15-dehydro-prostaglandin I2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:57408 name: 15-dehydro-prostaglandin D2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:57409 name: 15(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:57410 name: 15-oxo-ETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131859 ! oxo-ETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:57411 name: (15Z)-12-oxophyto-10,15-dienoate subset: chebi_ph7_3 is_a: CHEBI:167055 ! Jasmonate derivatives is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:57412 name: (3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57413 name: (1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57414 name: (1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57415 name: N-(carboxylatoaminomethyl)urea subset: chebi_ph7_3 is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:57416 name: D-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:66916 ! alanine zwitterion [Term] id: CHEBI:57417 name: 2,3-dihydroxybenzoyl 5'-adenylate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57418 name: (2-aminoethyl)phosphonic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57421 name: (2E,6E,10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57422 name: (2R,3S)-2,3-dimethylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57423 name: (R)-2-ethylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57424 name: (R)-3,3-dimethylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57425 name: 3-ethylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57426 name: sinapoyl (S)-malate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57427 name: L-leucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57428 name: (3R)-beta-leucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57429 name: (2S,3R)-3-hydroxybutane-1,2,3-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:141790 ! 3-hydroxybutane-1,2,3-tricarboxylate is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57430 name: (2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57431 name: N-(ammoniomethyl)urea subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57432 name: gibberellin A12 aldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:57433 name: sarcosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:66884 ! N-alkylglycine zwitterion [Term] id: CHEBI:57434 name: (3S)-3,6-diammoniohexanoate subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:57435 name: (3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57436 name: (3S,5S)-3,5-diammoniohexanoate subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:57437 name: (2R,3Z)-phycocyanobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:57438 name: (3Z)-phycoerythrobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:57439 name: (3Z)-phytochromobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:57440 name: N-ethylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:66884 ! N-alkylglycine zwitterion [Term] id: CHEBI:57441 name: 2,3-diketogulonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57442 name: (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57443 name: S-adenosylmethioninaminium subset: chebi_ph7_3 is_a: CHEBI:26830 ! sulfonium compound is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57444 name: 12(S)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57445 name: thromboxane A2(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62945 ! thromboxane anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57446 name: 15(S)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57447 name: 8(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:146288 ! 8-HPETE(1-) is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:57448 name: (5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57449 name: (5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57450 name: 5(S)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57451 name: dihydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:67014 ! dihydrofolates relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57452 name: 10-formyldihydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:67014 ! dihydrofolates [Term] id: CHEBI:57453 name: (6S)-5,6,7,8-tetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57454 name: 10-formyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57455 name: (6R)-5,10-methenyltetrahydrofolate subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:67016 ! tetrahydrofolate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57456 name: 5-formimidoyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57457 name: (6S)-5-formyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57458 name: (S)-NADHX(1-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57459 name: (6S)-6-hydroxyhyoscyaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57460 name: 20-hydroxy-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57461 name: leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:62942 ! leukotriene anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57462 name: leukotriene E4(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:62942 ! leukotriene anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57463 name: leukotriene A4(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62942 ! leukotriene anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57464 name: 5'-xanthylate(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57466 name: 13(S)-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:90823 ! 13-HPODE(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57467 name: (11S)-11-hydroperoxylinoleate subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) [Term] id: CHEBI:57468 name: 7(S),8(S)-DiHODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57469 name: (2E)-2-(methoxycarbonylmethyl)but-2-enedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57470 name: (2E)-3-(methoxycarbonyl)pent-2-enedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57471 name: (1E)-4-oxobut-1-ene-1,2,4-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57472 name: (N(omega)-L-arginino)succinate(1-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57473 name: 3'-demethylstaurosporinium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57474 name: (R)-S-lactoylglutathionate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57475 name: D-4-hydroxyphenylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:57476 name: L-homoserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57477 name: dTDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57478 name: alpha-maltose 6'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:91177 ! maltose 6'-phosphate(2-) [Term] id: CHEBI:57479 name: 2,6-dioxo-6-phenylhexanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57480 name: 2,3-dihydrobiochanin A(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57481 name: UTP(3-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:57482 name: streptomycin 3''-phosphate(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:57483 name: sedoheptulose 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57484 name: trimethylenediaminium subset: chebi_ph7_3 is_a: CHEBI:70977 ! alkane-alpha,omega-diammonium(2+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57485 name: carnosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57486 name: 4-guanidinobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57487 name: pyruvate oxime subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57488 name: hydrogen phosphonatoacetate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57490 name: N-carbamoylsarcosinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57491 name: staurosporinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57492 name: isopropylaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57493 name: pseudotropinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57495 name: 2-aminomuconate 6-semialdehyde(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57496 name: 3-carboxy-cis,cis-muconate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57497 name: dolichyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57498 name: ADP alpha-D-glucoside(2-) subset: chebi_ph7_3 is_a: CHEBI:138068 ! ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) is_a: CHEBI:76533 ! NDP-alpha-D-glucose(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57499 name: 2-oxoadipate(2-) subset: chebi_ph7_3 is_a: CHEBI:133294 ! oxo dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57501 name: (S)-4-amino-5-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57502 name: nicotinate D-ribonucleotide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57503 name: anthocyanidin 3,5-di-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:57504 name: L-dopa zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57505 name: N-benzoyl-D-argininium-4-nitroanilide(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:57506 name: 3,5-diiodo-L-tyrosinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57508 name: D-erythritol 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57509 name: L-dopachromate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57510 name: dTDP-6-deoxy-beta-L-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57511 name: cephalosporin C(1-) subset: chebi_ph7_3 is_a: CHEBI:52440 ! cephalosporin carboxylic acid anion [Term] id: CHEBI:57512 name: N-acyl-D-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:57513 name: N-acetyl-D-glucosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57514 name: 1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:77578 ! monoalkyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77611 ! monoalk-1-enyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:78203 ! 1-(alk-1-enyl)-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:57515 name: 3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:57516 name: deoxylimononate D-ring-lactone(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57518 name: 1-palmitoyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:63582 ! 1-palmitoylglycerol 3-phosphate(2-) [Term] id: CHEBI:57519 name: alpha,beta-didehydrotryptophanate(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:57520 name: D-octopine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:57521 name: beta-L-arabinose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57522 name: 12-dehydrotetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57523 name: dolichyl D-mannosyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57524 name: O-phosphonato-L-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:67032 ! O-phosphonatooxyserine(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57525 name: dolichyl beta-D-glucosyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57526 name: N(6)-(dimethylallyl)adenosine 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57527 name: GDP-alpha-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57528 name: 5-hydroxy-6-methylpyridine-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57529 name: 17alpha-estradiol 3-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:57531 name: L-serine O-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:57532 name: 8-amino-7-oxononanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57533 name: geranylgeranyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57534 name: 1-acylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57535 name: 4-phosphonato-L-aspartic acid(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57536 name: (7R)-7-(5-carboxy-5-oxopentanamido)cephalosporanate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:52440 ! cephalosporin carboxylic acid anion [Term] id: CHEBI:57537 name: N-acylneuraminate 9-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57538 name: orotidine 5'-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57539 name: 1D-myo-inositol 3,4,5,6-tetrakisphosphate(8-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57540 name: NAD(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:13193 ! hydrogen acceptor relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57541 name: 2-(alpha-D-mannosyl)-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:57542 name: aryl(methyl)malonate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57543 name: 3-(uracil-1-yl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57545 name: luteolin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57547 name: CDP-N-methylethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57548 name: o-orsellinate depsidate(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57549 name: N(2)-(carboxylatoacetyl)-D-tryptophanate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57551 name: S-methyl 3-O-phosphonato-1-thio-D-glycerate(2-) subset: chebi_ph7_3 is_a: CHEBI:51277 ! thioester is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57552 name: 2-oxopropyl-CoM(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:57553 name: P(1),P(4)-bis(5'-guanosyl) tetraphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57554 name: tropinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57555 name: L-2-amino-4-chloropent-4-enoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:57556 name: S-(3-carboxylatopropanoyl)glutathionate(2-) subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:57557 name: (R)-5-diphosphonatomevalonate(4-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57558 name: trans-2,3-epoxysuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:32955 ! epoxide is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:57559 name: alpha-D-xylose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57560 name: long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:57561 name: L-threonate subset: chebi_ph7_3 is_a: CHEBI:15243 ! threonate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57562 name: (R)-2-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:76724 ! 2-hydroxyoctadecanoate [Term] id: CHEBI:57563 name: 2-amino-4-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:57564 name: ADP-L-glycero-D-manno-heptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57565 name: serine phosphoethanolamine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57566 name: 2'-deoxycytosine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:142209 ! pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57567 name: N(6)-(1,2-dicarboxylatoethyl)-AMP(4-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57569 name: 2-dehydro-3-deoxy-6-phosphonato-D-gluconate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:57570 name: dolichyl diphosphooligosaccharide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57572 name: UDP-D-apiose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57575 name: trans-5-O-(4-coumaroyl)-D-quinate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57576 name: 2,3-dihydroxy-2,3-dihydrobenzoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57577 name: poly(glycerol phosphate) anion macromolecule subset: chebi_ph7_3 is_a: CHEBI:37997 ! homopolymer macromolecule is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57578 name: 6-O-methylnorlaudanosolinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57579 name: D-fructose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57580 name: diphthamide zwitterion subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:57581 name: (S)-coclaurinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57582 name: dTDP-4-amino-4,6-dideoxy-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57583 name: 6-imino-5-oxocyclohexa-1,3-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:57584 name: aldehydo-D-glucose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57585 name: discadenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57586 name: biotinate subset: chebi_ph7_3 is_a: CHEBI:176841 ! vitamin B7 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57587 name: stipitatate(2-) is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57588 name: phosphatidyl-N-methylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57589 name: O-acetyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:73024 ! O-acetylcarnitine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57590 name: O-phosphonato-L-homoserine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57592 name: cyclohexylsulfamate subset: chebi_ph7_3 is_a: CHEBI:61660 ! organic sulfamate oxoanion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:57593 name: 3-guanidinopropanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57594 name: O-carbamoyl-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57595 name: L-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:62031 ! polar amino acid zwitterion [Term] id: CHEBI:57596 name: dTDP-4-amino-4,6-dideoxy-D-galactose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57597 name: sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57598 name: 1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinolinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57599 name: N-acyl-D-glucosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57600 name: GTP(3-) is_a: CHEBI:37121 ! guanosine 5'-phosphate is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57601 name: 2-methylpropanaminium subset: chebi_ph7_3 is_a: CHEBI:58001 ! primary aliphatic ammonium ion [Term] id: CHEBI:57602 name: (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57603 name: ethanolaminium(1+) subset: chebi_ph7_3 is_a: CHEBI:58001 ! primary aliphatic ammonium ion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57604 name: 3-phosphonato-D-glyceroyl phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57605 name: adenin-9-yl riburonosate(1-) subset: chebi_ph7_3 is_a: CHEBI:26394 ! purine nucleoside is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57606 name: 5-oxoprolinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57607 name: oleandomycin 2'-O-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57608 name: CDP-ribitol(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57609 name: (2S,6S)-2,6-diaminopimelic acid dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:57610 name: N(alpha),N(alpha)-dimethyl-L-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57612 name: phosphonatoguanidiniumylacetate(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57613 name: phosphatidylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:57614 name: ITP(3-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57616 name: L-methioninium residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:57617 name: alpha-D-galactosyl undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57618 name: FMNH2(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57619 name: CDP-abequose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57620 name: poly(ribitol phosphate) polyanion is_a: CHEBI:26172 ! poly(ribitol phosphate)s is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57621 name: 2-benzylsuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:57623 name: prenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59544 ! phosphoantigen relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57626 name: limonin 17-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23931 ! epoxy monocarboxylic acid is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:57627 name: 1D-myo-inositol 1,4,5,6-tetrakisphosphate(8-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57628 name: 2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57629 name: D-glucopyranose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57630 name: gamma-amino-beta-hydroxybutyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57631 name: dTDP-L-dihydrostreptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57632 name: UDP-alpha-D-xylose(2-) subset: chebi_ph7_3 is_a: CHEBI:140359 ! UDP-monosaccharide(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57633 name: (S)-3-(indol-3-yl)-2-oxobutyrate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57634 name: beta-D-fructofuranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57635 name: UDP-alpha-D-galacturonate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57637 name: 2-methylene-3-methylsuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57638 name: GDP-6-deoxy-alpha-D-talose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57639 name: 4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57640 name: 1,6-dihydroxy-2-methylcyclohexa-2,4-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57641 name: 2,4-dichloro-5-oxo-2,5-dihydro-2-furylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:36683 ! organochlorine compound [Term] id: CHEBI:57642 name: glycerone phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57643 name: 1,2-diacyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:36313 ! glycerophosphocholine is_a: CHEBI:64482 ! phosphatidylcholine [Term] id: CHEBI:57644 name: chlorogenate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:57646 name: N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide anion subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57647 name: 3-(4-hydroxy-3,5-diiodophenyl)lactate subset: chebi_ph7_3 is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:57649 name: dTDP-4-dehydro-6-deoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57651 name: 2-deoxy-D-ribose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57652 name: chondroitin D-glucuronate anion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:57653 name: 2-deoxy-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:57654 name: undecaprenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:157763 ! polyprenol phosphate anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57655 name: 3-dehydro-L-gulonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57656 name: 1-guanidino-1-deoxy-scyllo-inositol 4-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:57657 name: 11-O-demethyl-17-O-deacetylvindolinium(1+) subset: chebi_ph7_3 is_a: CHEBI:60082 ! vinca alkaloid cation [Term] id: CHEBI:57658 name: 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:147335 ! 1-phosphatidyl-1D-myo-inositol-3-phosphate anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83191 ! phosphatidylinositol bisphosphate(5-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57660 name: myo-inositol 1,3,4,6-tetrakisphosphate(8-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57661 name: O-succinyl-L-homoserinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:57662 name: S-carboxylatomethyl-L-cysteine(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57663 name: 2-caffeoylisocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57664 name: 6-hydroxynicotinate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57665 name: neryl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57666 name: N-acyl-D-mannosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57667 name: dADP(3-) subset: chebi_ph7_3 is_a: CHEBI:73316 ! 2'-deoxyribonucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57668 name: D-ornithinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:46912 ! ornithinium(1+) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57670 name: N-acylglycinate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:57671 name: 1-ammonio-1-deoxy-scyllo-inositol subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:57672 name: 7-O-acetylsalutaridinol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57673 name: 2'-deoxyguanosine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:142198 ! purine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57674 name: N-acylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:84404 ! ceramide 1-phosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57676 name: questin-2-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57677 name: sn-3-O-(geranylgeranyl)glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57678 name: 3-mercaptopyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57679 name: hypotaurocyamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:5768 name: (1E,4E,8E)-alpha-humulene subset: chebi_ph7_3 is_a: CHEBI:49311 ! alpha-humulene [Term] id: CHEBI:57680 name: sinapoyltartronate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57681 name: cis-2-chloro-4-carboxylatomethylenebut-2-en-1,4-olide subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57682 name: coformycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:57683 name: dolichyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57684 name: beta-D-glucose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57685 name: sn-glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:231935 ! glycerol 1-phosphate(2-) relationship: has_role CHEBI:78947 ! archaeal metabolite [Term] id: CHEBI:57688 name: S-formylglutathionate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57689 name: 2,2-dialkylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57690 name: cis-4-hydroxy-D-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57691 name: N(6)-acyl-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57692 name: FAD(3-) subset: chebi_ph7_3 is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57693 name: aldehydo-D-arabinose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:57694 name: quercetin-7-olate subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:57695 name: D-ribitol 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57697 name: deaminohydroxyblasticidin S(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57698 name: 2-(acetamidomethylidene)succinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57699 name: L-histidinol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57700 name: 2-methyl-3-oxopropanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57701 name: 5-O-(1-carboxylatovinyl)-3-phosphonatoshikimate subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57702 name: N-acetyl-L-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:57703 name: 2-nitrophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:57704 name: cationic chitosan subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57705 name: UDP-N-acetyl-alpha-D-glucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:140359 ! UDP-monosaccharide(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57706 name: 4-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion is_a: CHEBI:71944 ! aldehydic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57707 name: 2,3-bis-O-(geranylgeranyl)glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57708 name: benzoylagmatinium subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:57709 name: 2-amino-3-oxo-4-(phosphonatooxy)butanoate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57710 name: 5,12-dihydroxanthommatin(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57711 name: all-trans-octaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:57712 name: 2-hydroxy-3-oxoadipate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57713 name: 3-(2-carboxylatoethenyl)-cis,cis-muconate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57714 name: 2-ureidoglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:57715 name: UDP-N-acetyl-D-mannosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57716 name: O-acetyl-L-homoserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57718 name: barbiturate(2-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57719 name: D-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:64554 ! tryptophan zwitterion [Term] id: CHEBI:57720 name: alpha-D-ribose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57721 name: 3-amino-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57722 name: N(2),N(5)-dibenzoyl-L-ornithinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:57723 name: sucrose 6(F)-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57724 name: dCTP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57726 name: D-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:57727 name: N-formylmethanofuran(5-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:57728 name: morphiniumone(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57729 name: 3alpha-hydroxyglycyrrhetinate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:57730 name: 2-hydroxy-4-nitrophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:57731 name: (R)-3-aminoisobutyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:142590 ! 3-aminoisobutanoic acid zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57732 name: 4-carboxylato-2-hydroxyhexa-2,4-dienedioate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57733 name: myo-inositol 1,3,4,5,6-pentakisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57734 name: alpha-D-hexose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57735 name: 2-oxosuccinamate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57736 name: UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysine(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57737 name: D-xylulose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57738 name: 2-arylpropionate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:57739 name: phosphatidate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57740 name: L-5-carboxylatomethylhydantoin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57741 name: phenylethanolaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57742 name: guanidinoacetic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57743 name: L-citrulline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:57744 name: 2-(alpha-D-mannosyl)-3-phosphonatoglycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57745 name: 4-hydroxy-1-pyrroline-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57746 name: 3',5'-cyclic GMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57747 name: 3-(pyrazol-1-yl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57750 name: N(tele)-methyl-L-histidinium residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:57752 name: (S)-3-(imidazol-5-yl)lactate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57753 name: vindolinium(1+) subset: chebi_ph7_3 is_a: CHEBI:60082 ! vinca alkaloid cation [Term] id: CHEBI:57754 name: trans-5-O-caffeoyl-D-quinate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:57755 name: (R)-N-methylcoclaurinium subset: chebi_ph7_3 is_a: CHEBI:38818 ! N-methylcoclaurine [Term] id: CHEBI:57756 name: sphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57757 name: D-threonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:57758 name: N(3)-(carboxylatoformyl)-L-2,3-diaminopropionate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:57759 name: gossypetin-3-olate is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57760 name: 3-oxoglycyrrhetinate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:57761 name: pyridoxaminium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:27306 ! vitamin B6 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57762 name: L-valine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:57763 name: limonoate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57764 name: 1-deoxy-D-altro-heptulose 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:35133 ! ketoheptose phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57766 name: 3-(imidazol-4-yl)-2-oxopropyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57767 name: mono(glucosyluronic acid)bilirubin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57768 name: 4-coumaroylshikimate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57769 name: precorrin-4(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:57770 name: trans-caffeate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57771 name: UDP-N-acetyl-3-O-(1-carboxylatovinyl)-D-glucosamine(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57772 name: N-acetyl-L-histidinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion is_a: CHEBI:66998 ! histidinate derivative [Term] id: CHEBI:57773 name: N-(carboxylatomethyl)-D-alanine subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:57774 name: 2-acetyllactate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57775 name: stipitaton-4-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57776 name: N-acetyl-alpha-D-glucosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57777 name: 1,4,5,6-tetrahydro-6-oxonicotinate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:57778 name: triacetate lactone oxoanion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57779 name: tauropinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:57781 name: N-methylethanolaminium phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57782 name: cortisol 21-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:57783 name: NADPH(4-) subset: chebi_ph7_3 is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion relationship: has_role CHEBI:17499 ! hydrogen donor relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57784 name: 2-[3-carboxylato-3-(methylammonio)propyl]-L-histidine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57787 name: streptomycin 6-phosphate(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:57788 name: isonocardicin A(1-) is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57790 name: benzyl cetraxate(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57791 name: meso-2,6-diaminopimelic acid dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57792 name: 1-deoxy-D-xylulose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57794 name: dGTP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57795 name: 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83189 ! phosphatidylinositol monophosphate(3-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57797 name: dihydrostreptomycin 6-phosphate(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:57798 name: 1D-myo-inositol 1,2,4,5,6-pentakisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:57799 name: 4',5-dihydroxy-3'-methoxyflavon-7-olate(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57800 name: 3-ADP-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57801 name: cyclotriphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:15266 ! triphosphate ion is_a: CHEBI:79387 ! trivalent inorganic anion [Term] id: CHEBI:57803 name: L-tryptophanamide(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57804 name: L-serine phosphoethanolamine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57805 name: N(2)-acetyl-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57806 name: UDP-N-acetyl-D-galactosamine 4,6-bissulfate(4-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57807 name: UDP-2-acetamido-4-amino-2,4,6-trideoxy-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57808 name: xanthommatin(1-) subset: chebi_ph7_3 is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:57809 name: N-formyl-L-methioninate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:57810 name: UDP-4-dehydro-6-deoxy-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57811 name: sym-homospermidinium(3+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57812 name: CMP-N-acetyl-beta-neuraminate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57813 name: quercetin 3,3',7-trissulfate(3-) is_a: CHEBI:139371 ! aryl sulfate oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57814 name: triacetate(1-) subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:57815 name: luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)] is_a: CHEBI:60038 ! flavonoid oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:57817 name: sphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57818 name: 5,10-methylenetetrahydromethanopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57819 name: quinolin-4(1H)-one-3-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57820 name: N(6)-hydroxy-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57822 name: D-alanyl-D-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:57823 name: 4-CDP-2-C-methyl-D-erythritol(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57824 name: oxalurate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57825 name: L-lombricine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57826 name: 6-aminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57828 name: D-hamamelose 2(1)-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57829 name: L-xylulose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57830 name: cyanidin 3-O-rutinoside 5-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:57831 name: glycerol 1,2-cyclic phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57832 name: 1,2-diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57833 name: N-benzoyl-4-hydroxyanthranilate subset: chebi_ph7_3 is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:57834 name: spermidine(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:57835 name: glutathionylspermidinium(2+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:57836 name: 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate(7-) subset: chebi_ph7_3 is_a: CHEBI:147335 ! 1-phosphatidyl-1D-myo-inositol-3-phosphate anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83193 ! phosphatidylinositol trisphosphate(7-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57837 name: dTDP-4-dehydro-6-deoxy-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57838 name: N-phosphonatotaurocyamine(2-) subset: chebi_ph7_3 is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:57839 name: 3-dehydro-2-deoxy-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:57840 name: methylguanidinium subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:57841 name: 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57842 name: vitexin 2''-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57843 name: L-selenocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57844 name: L-methionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64558 ! methionine zwitterion [Term] id: CHEBI:57845 name: preuroporphyrinogen(8-) subset: chebi_ph7_3 is_a: CHEBI:59252 ! linear tetrapyrrole anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57846 name: L-fuculose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57847 name: UDP-N-acetyl-D-galactosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57848 name: 1,4-diguanidiniumylbutane subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:57849 name: (R)-4-dehydropantoate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57850 name: 3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronate)-D-galactosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:57851 name: tropiniumone subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57852 name: prephenate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:57853 name: hypotaurine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57854 name: 4-guanidiniumylbutanal subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:57855 name: protochlorophyllide(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:57856 name: S-adenosyl-L-homocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57857 name: N-acetyl-beta-alaninate subset: chebi_ph7_3 is_a: CHEBI:49095 ! beta-amino-acid anion [Term] id: CHEBI:57858 name: atropinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:57859 name: 5-(3-carboxylato-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57861 name: dethiobiotin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57862 name: diphthamide(2+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:57863 name: ADP-D-glycero-D-manno-heptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57864 name: (4S,5S)-5-hydroxy-4-(hydroxymethyl)-6-oxocyclohex-1-en-1-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57865 name: uridine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138238 ! pyrimidine ribonucleoside 5'-monophosphate(2-) is_a: CHEBI:26443 ! pyrimidine ribonucleoside monophosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57866 name: 3-methylthiopropylaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57867 name: nucleoside 5'-phosphate dianion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57868 name: N-sulfo-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:61660 ! organic sulfamate oxoanion [Term] id: CHEBI:57869 name: 6-aminopenicillanic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57870 name: D-ribulose 1,5-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57871 name: codeine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57872 name: (Z)-but-2-ene-1,2,3-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57873 name: (S)-reticulinium(1+) subset: chebi_ph7_3 is_a: CHEBI:194518 ! reticuline(1+) is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57875 name: 2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:11502 ! 2-acylglycerophosphocholine is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:78192 ! 1-lysophosphatidylcholine is_a: CHEBI:84465 ! acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:57876 name: CDP-ethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57877 name: N-acetyl-D-tryptophanate subset: chebi_ph7_3 is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:57878 name: 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronate)-6-O-sulfonato-D-galactopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:57879 name: 4-methylene-L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57880 name: 1-phosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:143813 ! 1-radyl,2-acyl-sn-glycero-3-phospho-(1D-myo-2-acyl-inositol)(1-) is_a: CHEBI:147334 ! 1-phosphatidyl-1D-myo-inositol anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:78231 ! 1,2-diacylglycero-3-phospho-1-inositol(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57882 name: erythro-5-phosphonatoooxy-L-lysinium(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57883 name: 4-carboxylatomethyl-3-methylbut-2-en-1,4-olide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57885 name: 3-dehydrocarnitine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57886 name: 2'-deoxy-5-methyl-5'-cytidylate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57887 name: tryptaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:65296 ! primary ammonium ion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57888 name: 4-carboxylatomethyl-4-methylbut-2-en-1,4-olide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57889 name: N(5)-(L-1-carboxyethyl)-L-ornithine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57890 name: adenosine 5'-phosphoramidate(1-) subset: chebi_ph7_3 is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:57891 name: trans-2-chloro-4-carboxylatomethylenebut-2-en-1,4-olide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57892 name: 3-(dioxido-lambda(5)-azanylidene)propanoate(2-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:57893 name: tabersoninium(1+) subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:57894 name: berbamuninium(2+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57895 name: 1D-myo-inositol 1,3,4,5-tetrakisphosphate(8-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57896 name: diisopropyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion [Term] id: CHEBI:57897 name: 1-phosphonato-alpha-D-glucuronate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:57899 name: 15,16-dihydrobiliverdin(2-) subset: chebi_ph7_3 is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:57900 name: oxidized Photinus luciferin(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:57901 name: L-threo-3-phenylserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57902 name: 1-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57903 name: [1-(5-phosphonatoribosyl)imidazol-4-yl]acetate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57904 name: D-glucose 6-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:57905 name: dehydroepiandrosterone sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57906 name: trans-4-hydroxycyclohexanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57907 name: all-trans-pentaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57908 name: N-benzoyl-D-arginine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57909 name: kanamycin A 3'-phosphate(2+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57912 name: L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion is_a: CHEBI:64554 ! tryptophan zwitterion [Term] id: CHEBI:57914 name: kievitone-7-olate is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57915 name: L-gamma-glutamyl-D-alaninate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:57916 name: 3-hexaprenyl-4-hydroxy-5-methoxybenzoate subset: chebi_ph7_3 is_a: CHEBI:84443 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57917 name: 4-nitrophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:57918 name: alpha-ribazole 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57919 name: 4-CDP-2-C-methyl-D-erythritol 2-phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57920 name: bis(3-azaniumylpropyl)azanium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57921 name: N(3')-acetyl-2-deoxystreptamine antibiotic(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57922 name: coenzyme gamma-F420-2(5-) subset: chebi_ph7_3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:59535 ! pyrimidoquinolines [Term] id: CHEBI:57923 name: 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83191 ! phosphatidylinositol bisphosphate(5-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57924 name: L-dopaquinone zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57925 name: glutathionate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57926 name: L-threonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57927 name: oxaloacetate 4-methyl ester subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57928 name: 3',4',5-trihydroxy-3-methoxyflavon-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57929 name: 7''-O-phosphohygromycin B(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57930 name: nucleoside 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57931 name: D-ribofuranosyl-ADP(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57932 name: D-methionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64558 ! methionine zwitterion [Term] id: CHEBI:57933 name: oleandomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57934 name: psychosine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57935 name: oxidized Watasenia luciferin(2-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion [Term] id: CHEBI:57936 name: N-acetyl-L-gamma-glutamyl phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57937 name: (2Z,4E)-2-aminomuconate(2-) is_a: CHEBI:189700 ! 2-aminomuconate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57938 name: trans-3-hydroxy-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57939 name: sphinganine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57940 name: 3-sulfonatopyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57942 name: chlorophyllide a(1-) is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:57945 name: NADH(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:17499 ! hydrogen donor relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57946 name: N-methylphenylethanolaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57947 name: creatine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57948 name: 5-oxo-D-prolinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:57949 name: 6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3-) subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57951 name: L-saccharopinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35753 ! tricarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57952 name: sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57953 name: UDP-N-acetylmuramoyl-L-alaninate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57954 name: 3-cyano-L-alaninate is_a: CHEBI:59814 ! L-alpha-amino acid anion is_a: CHEBI:66934 ! cyanoamino acid anion [Term] id: CHEBI:57955 name: 6-O-phosphonato-D-glucono-1,5-lactone(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57956 name: 3-amino-3-(4-hydroxyphenyl)propanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:57957 name: lipid X(2-) subset: chebi_ph7_3 is_a: CHEBI:137180 ! 2,3-diacyl-alpha-D-glucosaminyl 1-phosphate is_a: CHEBI:176338 ! 2-N,3-O-bis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57958 name: (R)-2,4-dihydroxy-3-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57959 name: L-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57962 name: 5-hydroxymethyldeoxycytidylate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:57963 name: vitexin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:57964 name: GDP-4-dehydro-6-deoxy-alpha-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57965 name: deacetoxyvindolinium(1+) subset: chebi_ph7_3 is_a: CHEBI:60082 ! vinca alkaloid cation [Term] id: CHEBI:57966 name: beta-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57967 name: ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57968 name: UDP-N-acetylmuramoyl-L-alanyl-D-glutamate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:57969 name: imidazol-4-ylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57970 name: 1-acyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77589 ! monoacyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:78166 ! 2-lysophosphatidate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57971 name: hygromycin B(3+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57972 name: L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:66916 ! alanine zwitterion [Term] id: CHEBI:57973 name: leukotriene C4(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion is_a: CHEBI:62942 ! leukotriene anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57974 name: O-(3-O-D-galactosyl-N-acetyl-beta-D-galactosaminyl)-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57975 name: 1-(4-hydroxy-2-methylpyrimid-5-ylmethyl)-3-(2-hydroxyethyl)-2-methylpyridinium subset: chebi_ph7_3 is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:57976 name: 2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:57977 name: bilirubin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57978 name: 2-hydroxy-3-oxopropanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:57979 name: 2-(carboxylatomethyl)-5-oxo-2,5-dihydro-2-furoate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57980 name: L-histidinol phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57981 name: D-phenylalanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:57982 name: 1-acyl-2-[(S)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:57984 name: GDP-L-fucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57985 name: S-inosyl-L-homocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57986 name: riboflavin(1-) subset: chebi_ph7_3 is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:60531 ! flavin(1-) relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:57987 name: 2-hydroxyadipate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:57988 name: allysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:57989 name: 2-dehydro-3-deoxy-D-galactonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:57990 name: 2-dehydro-3-deoxy-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:57991 name: biliverdin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:57992 name: 2-(carboxylatomethoxy)succinate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:57993 name: (S)-N-methylcoclaurinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57994 name: 2,3,5,6-tetrachlorobenzene-1,4-bis(olate) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:57995 name: all-trans-undecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:57996 name: nororientalinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:57997 name: 6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol zwitterion subset: chebi_ph7_3 is_a: CHEBI:143816 ! alpha-D-glucosaminyl-(1->6)-(phosphatidyl)-(1-radyl,2-acyl-sn-glycero-3-phospho)-1D-myo-inositol zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:57998 name: 3-phosphoglycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:132960 ! 3-phosphoglycerate is_a: CHEBI:61304 ! phosphoglycerate [Term] id: CHEBI:57999 name: 1-carboxylatovinyl carboxylatophosphonate(3-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:58000 name: D-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58001 name: primary aliphatic ammonium ion subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:58002 name: L-erythrulose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58003 name: 3',5'-cyclic CMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58004 name: 3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58005 name: N-amidino-L-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:58006 name: Cypridina luciferin(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58007 name: streptomycin(3+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58008 name: 2-carboxylato-D-arabinitol(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58009 name: L-gamma-glutamyl-L-cysteinyl-beta-alaninate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:58010 name: (S)-3'-hydroxy-N-methylcoclaurinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58011 name: (1R,2R,3R)-prephytoene diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58012 name: strictosidine aglycone(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58013 name: aspulvinone H(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58014 name: 1-alkyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77576 ! monoalkyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:78168 ! 1-alkylglycerol 3-phosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58015 name: 7,8-dihydro-7,8-dihydroxykynurenate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:38773 ! quinolinemonocarboxylate [Term] id: CHEBI:58016 name: 1-guanidiniumyl-1-deoxy-scyllo-inositol(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58017 name: 5-O-phosphonato-alpha-D-ribofuranosyl diphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58018 name: N(5)-formyl-5,6,7,8-tetrahydromethanopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58020 name: 2-aminoacrylate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58021 name: glucotropeolin(1-) subset: chebi_ph7_3 is_a: CHEBI:183098 ! (Z)-glucosinolate(1-) is_a: CHEBI:36452 ! aralkylglucosinolate [Term] id: CHEBI:58022 name: 10-oxocaprate subset: chebi_ph7_3 is_a: CHEBI:71944 ! aldehydic acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:58023 name: (3,5-diiodo-4-oxidophenyl)pyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:58024 name: deoxylimonoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58025 name: octopaminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58026 name: 8-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58027 name: glyceraldehyde 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58028 name: 6-O-sulfonato-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->6)-alpha-D-Glc-(1->3)-1-O-alkyl-2-O-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:58029 name: cysteaminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58030 name: 5-formyl-2-hydroxyhepta-2,4-dienedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58031 name: 2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58032 name: anhydrotetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58033 name: 2-phosphonatoglycolate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58034 name: flavonol 3-O-(6-O-malonyl-beta-D-glucoside)(1-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:58035 name: 1D-3-ammmonio-1-guanidiniumyl-1,3-dideoxy-scyllo-inositol(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58037 name: O-demethylpuromycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58038 name: Photinus luciferin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58039 name: N-methylputrescinium(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58040 name: dimethylaminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:58855 ! secondary aliphatic ammonium ion [Term] id: CHEBI:58041 name: heparosan N-sulfate L-iduronate polyanion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58042 name: guanidinoethyl methyl phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58043 name: nucleoside 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58044 name: 2,5-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58045 name: L-isoleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:58046 name: 3,5-dibromo-4-oxidobenzonitrile(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:58047 name: thiomorpholine-3-carboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58048 name: L-asparagine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58050 name: dolichyl N-acetyl-alpha-D-glucosaminyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58051 name: 4,5-dihydroxyphthalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58052 name: UDP-alpha-D-glucuronate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58053 name: IMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58055 name: 4,5-dioxopentanoate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:58056 name: 2-methylideneglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58057 name: geranyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58058 name: D-lysopine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:58059 name: oxidized Cypridina luciferin(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58061 name: salutaridinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58062 name: rosmarinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58064 name: taurocyamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58065 name: homocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58066 name: L-glutamic 5-semialdehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58067 name: (3Z,5S)-3-(1-oxidoethylidene)-5-\{[4-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]methyl}pyrrolidine-2,4-dione(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58068 name: 2-hydroxy-6-oxohexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58069 name: CDP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58070 name: dehydroascorbide(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58071 name: mono(2-ethylhexyl) phthalate(1-) subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:58072 name: carbon monoxide(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:58074 name: D-nopalinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58075 name: 2-hydroxy-4-oxobutane-1,2,4-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58077 name: bis-gamma-glutamylcystinate(2-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58078 name: CDP-3,6-dideoxy-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58079 name: butanoyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58080 name: N(4)-(beta-N-acetyl-D-glucosaminyl)-L-asparagine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58081 name: dTDP-D-galacturonate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58082 name: O-(1->4)-alpha-L-dihydrostreptosylstreptidine 6-phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58083 name: glycerol 2-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58085 name: 2-isopropylmaleate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58086 name: UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:58087 name: N-(3-carboxylatopropionyl)-LL-2,6-diaminopimelate(2-) subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58088 name: 1-phosphatidyl-1D-myo-inositol 3-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:147335 ! 1-phosphatidyl-1D-myo-inositol-3-phosphate anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83189 ! phosphatidylinositol monophosphate(3-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58089 name: 5-phosphonato-D-ribosylaminium(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58090 name: L-cysteate(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58091 name: deacetylisoipecoside(1+) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58092 name: N-phosphocreatinate(2-) subset: chebi_ph7_3 is_a: CHEBI:60345 ! organic phosphoramidate anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58093 name: homoserinium lactone subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58095 name: L-phenylalanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58096 name: dolichyl D-xylosyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58097 name: morphine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58098 name: 2-dehydro-3-deoxy-D-glucarate(2-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:58099 name: dTDP-6-deoxy-L-talose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:5810 name: hydroxymethylphosphonic acid is_a: CHEBI:26069 ! phosphonic acids is_a: CHEBI:64708 ! one-carbon compound relationship: has_role CHEBI:62609 ! EC 3.11.1.3 (phosphonopyruvate hydrolase) inhibitor [Term] id: CHEBI:58100 name: N(6),N(6),N(6)-trimethyl-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:58101 name: N(1)-acetylsperminium(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58102 name: 2-N,6-O-disulfonato-D-glucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:58103 name: 5,6,7,8-tetrahydromethanopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58104 name: nucleoside 5'-triphoshate(3-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:58105 name: N(6)-[(indol-3-yl)acetyl]-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:57691 ! N(6)-acyl-L-lysine zwitterion [Term] id: CHEBI:58106 name: UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N(6)-(L-alanyl)-L-lysyl-D-alanyl-D-alaninate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:58109 name: (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58110 name: CDP-3,6-dideoxy-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58111 name: N(5)-acyl-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58112 name: cetraxate zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58113 name: L-2-ammoniohexano-6-lactam subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58114 name: 2-carboxylato-cis,cis-muconate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58115 name: guanosine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58043 ! nucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58116 name: 5-methyl-5,6,7,8-tetrahydromethanopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58117 name: (S)-2-acetamido-6-oxopimelate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58118 name: L-rhamnonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58119 name: N(4)-phosphonatoagmatine(1-) subset: chebi_ph7_3 is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:58121 name: D-ribulose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58122 name: N(6)-acetyl-N(6)-hydroxy-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58123 name: (2S)-2-hydroxy monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58124 name: isovitexin 2''-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58125 name: 3-hydroxy-L-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58126 name: porphobilinogen(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58127 name: GDP-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:76533 ! NDP-alpha-D-glucose(2-) [Term] id: CHEBI:58128 name: N(5)-ethyl-L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58129 name: cis-caffeate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58130 name: myo-inositol hexakisphosphate(12-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58131 name: 2-methylpropanoyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58132 name: 3-chloro-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58133 name: 3-(imidazol-5-yl)pyruvate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:58135 name: 2-(hydroxymethyl)-4-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58136 name: 2,5-dioxopentanoate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:58137 name: 3,4-dihydroxyphthalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58138 name: N-caffeoylputrescinium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58139 name: 3-hydroxy-cis,cis-muconate(2-) subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:58140 name: tetrahydropteroyltri-L-glutamate(4-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58141 name: P(1),P(4)-bis(5'-adenosyl) tetraphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58142 name: 4-carboxy-2-hydroxy-cis,cis-muconate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58143 name: 5-dehydro-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58144 name: (R)-reticulinium(1+) subset: chebi_ph7_3 is_a: CHEBI:194518 ! reticuline(1+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58145 name: agmatinium(2+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58146 name: (R)-5-phosphonatomevalonate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58147 name: 4-(2-aminophenyl)-2,4-dioxobutanoate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58148 name: L-homocitrulline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58149 name: 3-hydroxyphenylacetate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:58150 name: 3-D-glucuronosyl-N(2),6-disulfonato-beta-D-glucosamine(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:61660 ! organic sulfamate oxoanion [Term] id: CHEBI:58151 name: methanofuranate(4-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:58152 name: cis-4-coumarate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58153 name: UDP-L-rhamnose(2-) subset: chebi_ph7_3 is_a: CHEBI:60981 ! UDP-rhamnose(2-) [Term] id: CHEBI:58154 name: N-(2,3-dihydroxybenzoyl)-L-serinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58155 name: N-methyltyraminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58156 name: N-adenylylanthranilate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:58157 name: 2-O-caffeoylglucarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58158 name: aminomalonate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:58159 name: uracil-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:38316 ! pyrimidinecarboxylate anion [Term] id: CHEBI:58161 name: L-cystathionine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58163 name: homocystine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58164 name: (S)-atropinium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58165 name: 3',5'-cyclic AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58166 name: CDP-4-dehydro-6-deoxy-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58168 name: 1-O-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:78191 ! 2-lysophosphatidylcholine is_a: CHEBI:84465 ! acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:58169 name: 2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58170 name: psychosine sulfate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58171 name: 7,8-dihydroxykynurenate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58172 name: dTDP-D-fucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58173 name: L-gamma-glutamyl-L-cysteinate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58174 name: but-1-ene-1,2,4-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58175 name: N-methyl-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58176 name: phenylthioacetohydroximate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58177 name: testolate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:58178 name: 1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:147334 ! 1-phosphatidyl-1D-myo-inositol anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83189 ! phosphatidylinositol monophosphate(3-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58179 name: all-trans-hexaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:167056 ! polyprenol diphosphate(3-) is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:58180 name: L-arogenate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:58181 name: trans-beta-D-glucosyl-2-hydroxycinnamate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58182 name: (S)-6-hydroxynicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58183 name: 6-amino-2-oxohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58184 name: L-tyrosiniumyl-L-arginine(1+) subset: chebi_ph7_3 is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:58185 name: 2-carboxylato-D-arabinitol 1-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58186 name: 1-phosphonato-alpha-D-galacturonate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58187 name: alginate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:58188 name: UDP-N-acetyl-D-galactosamine 4-sulfate(3-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58189 name: GDP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58190 name: O-phosphonatoethanaminium(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58191 name: 1-alkyl-2-acetyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78184 ! monoalkylmonoacylglycerolphosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58192 name: quercitrin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58193 name: 3alpha(S)-strictosidinium(1+) subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:58194 name: biochanin A(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58195 name: S-(5-deoxy-D-ribos-5-yl)-L-homocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58196 name: (3R)-3-hydroxy-L-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:58199 name: L-homocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58200 name: N(5)-methyl-L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58201 name: 6,7-dimethyl-8-(1-D-ribityl)lumazine(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58202 name: N(6)-methyl-L-lysinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:58203 name: 2-formylbenzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates is_a: CHEBI:71944 ! aldehydic acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:58205 name: 3-nitroacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58206 name: all-trans-heptaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:58207 name: 5-methyltetrahydropteroyltri-L-glutamate(4-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58209 name: 4-(3-methylbut-2-enyl)-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58210 name: FMN(3-) subset: chebi_ph7_3 is_a: CHEBI:176838 ! vitamin B2 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58211 name: dolichyl beta-D-mannosyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58212 name: dUTP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58213 name: ammonioacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:133427 ! omega-ammonioaldehyde is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58214 name: kanamycin A(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:58215 name: guanosine 3',5'-bis(diphosphate)(6-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58217 name: pentachlorophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:58218 name: 9-riburonosylhypoxanthine(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58219 name: mevaldate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58220 name: N-adenylyl-L-phenylalanate(2-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58222 name: 4-hydroxy-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58223 name: UDP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58224 name: GDP-6-deoxy-alpha-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58225 name: alpha-D-glucose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:61548 ! D-glucopyranose 6-phosphate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58226 name: L-ribulose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58227 name: 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58228 name: carbamoyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58229 name: Watasenia luciferin(2-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion [Term] id: CHEBI:58230 name: 2-(beta-D-glucopyranosyluronate)-D-glucuronate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:58231 name: CTP(3-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:58232 name: D-glucose 1,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58233 name: UDP-L-iduronate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58234 name: 3-hydroxyquininium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58236 name: N-feruloylglycinate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:58237 name: cis-4,5-dihydroxycyclohexa-2,6-diene-1,2-dicarboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58238 name: 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58239 name: 16-hydroxytabersoninium subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:58240 name: aspulvinone E(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58241 name: N(2)-(3-carboxylatopropionyl)-L-arginine(1-) subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58242 name: Renilla luciferyl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion [Term] id: CHEBI:58243 name: 5'-adenylyl sulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:58958 ! organosulfate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58244 name: nocardicin A(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58245 name: 2'-deoxyadenosine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:142198 ! purine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58246 name: sulfonatoacetaldehyde subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion [Term] id: CHEBI:58247 name: beta-D-glucose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58248 name: 2,3-bisphosphonato-D-glycerate(5-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58249 name: (S,S,S)-nicotianamine trizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58251 name: N,N-dimethylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58252 name: S-methyl-L-methionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:26830 ! sulfonium compound [Term] id: CHEBI:58253 name: (S)-norcoclaurinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58254 name: quercetin 3-sulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58255 name: aldehydo-D-galactose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58256 name: alpha-cyclopiazonate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58257 name: S-(4-bromophenyl)-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58259 name: dihydrostreptomycin 3'alpha,6-bisphosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58260 name: N(6)-acetyl-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58261 name: methyl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:58262 name: 2-C-methyl-D-erythritol 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58263 name: N-acetylputrescinium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58264 name: 4-ammoniobutanal subset: chebi_ph7_3 is_a: CHEBI:133427 ! omega-ammonioaldehyde is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58265 name: 2-hydroxy-3-oxosuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:133294 ! oxo dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:58266 name: 5-hydroxy-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58269 name: 2-amino-2-deoxy-D-gluconic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58270 name: N-acetyl-L-leucinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58272 name: 3-phosphonato-D-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58273 name: aldehydo-D-ribose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58274 name: L-gamma-glutamyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58275 name: 2-methylserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58276 name: 4-hydroxy-4-methyl-2-oxoglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:133294 ! oxo dicarboxylic acid dianion [Term] id: CHEBI:58277 name: dehydro-D-arabinono-1,4-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58278 name: D-erythro-1-(imidazol-4-yl)glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58279 name: 3-(3,4-dihydroxyphenyl)lactate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58280 name: IDP(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58282 name: 1D-myo-inositol 1,4-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58283 name: CDP-4-dehydro-3,6-dideoxy-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58284 name: 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:58285 name: 7-methylguanosine 5'-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58286 name: methyl-CoM(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:58287 name: heparosan-N-sulfate D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion is_a: CHEBI:85307 ! heparosan D-glucuronic acid zwitterion [Term] id: CHEBI:58289 name: 2-phosphonato-D-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58290 name: trypanothione(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:58291 name: 1D-1-guanidiniumyl-1-deoxy-3-dehydro-scyllo-inositol(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58292 name: (S)-naringenin(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58293 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine betaine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:58294 name: beta-N-acetylneuraminyl-2,3-beta-D-galactosyl-1,3-(beta-N-acetylneuraminyl-2,6)-N-acetyl-D-galactosaminyl(2-) subset: chebi_ph7_3 is_a: CHEBI:21507 ! N-acetyl-D-galactosaminyl group [Term] id: CHEBI:58295 name: S-acetylcysteaminium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58296 name: 4-methyl-5-(2-phosphonatooxyethyl)thiazole(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58297 name: glutathione disulfide(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58298 name: 6-phosphonato-2-dehydro-3-deoxy-D-galactate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58299 name: 3-dehydrosphinganinium(1+) subset: chebi_ph7_3 is_a: CHEBI:84411 ! 3-dehydrosphingoid base(1+) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58301 name: taurolithocholic acid sulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58302 name: UDP-2-acetamido-4-dehydro-2,6-dideoxy-beta-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58303 name: 1-palmitoylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57534 ! 1-acylglycerone 3-phosphate(2-) [Term] id: CHEBI:58304 name: 2-oxo-2H-pyran-4,6-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58305 name: quercetin 3,3'-bissulfate(3-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58306 name: rifamycin B(2-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58307 name: FADH2(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58308 name: 5-amino-4-chloro-2-(2-oxidomuconoyl)pyridazin-3(2H)-one(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58309 name: UDP-N-acetylmuramate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:583099 name: ent-zingiberene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:58310 name: N(2)-phenylacetyl-L-glutaminate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58311 name: (2R)-CDP-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58312 name: 6-phosphonato-beta-D-glucosyl-(1->4)-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58313 name: L-rhamnulose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58314 name: (2R)-2-hydroxy monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58315 name: L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58318 name: N-carbamoylputrescinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58319 name: coenzyme M(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:58320 name: ammonioacetone subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58321 name: L-allysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58322 name: 3-mercapto-2-mercaptomethylpropanoate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58323 name: hydrogenobyrinate(6-) is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58324 name: N(1)-acetylspermidinium(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58325 name: 1-ammonio-1-deoxy-scyllo-inositol 4-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:58326 name: N(omega),N(omega)-dimethyl-L-argininium(1+) subset: chebi_ph7_3 is_a: CHEBI:133775 ! dimethylargininium(1+) [Term] id: CHEBI:58328 name: D-allose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58329 name: (+)-taxifolin(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58330 name: 1-alpha-D-galactosyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58331 name: farnesyl triphosphate(3-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58332 name: CDP-diacylglycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58333 name: isoorientin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58334 name: cyclohexyl isocyanide(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:58335 name: sedoheptulose 1,7-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58336 name: alpha-D-galactose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58337 name: 5,10-(methanylylidene)tetrahydromethanopterin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58339 name: 3'-phosphonato-5'-adenylyl sulfate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:58958 ! organosulfate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58340 name: O-acetyl-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58341 name: UDP-L-arabinose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58342 name: acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:58343 name: adenosine 3',5'-bismonophosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58344 name: 3-(3,4-dioxidopyridinium-1-yl)-L-alanine(1-) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:58345 name: D-ribose 1,5-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58346 name: 2-hydroxy-3-(3-oxoprop-1-enyl)but-2-enedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58348 name: 3-[hydroxy(oxido)phosphoranyl]pyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:58349 name: NADP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:13193 ! hydrogen acceptor relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58351 name: sirohydrochlorin(8-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58352 name: 2-hydroxypropyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58353 name: quercetin-7-olate 3,4'-bissulfate(3-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58354 name: 4-amino-2-methyl-5-phosphonatooxymethylpyrimidine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58355 name: GDP-L-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58356 name: N-phosphonato-L-lombricine(2-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58357 name: erythro-5-hydroxy-L-lysinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58358 name: 4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58359 name: L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:62031 ! polar amino acid zwitterion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:58360 name: 1-aminocyclopropanecarboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58361 name: diphthinate subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58363 name: oxamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58365 name: 4-guanidiniumylbutanamide(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58366 name: deacetylcephalosporin C(1-) subset: chebi_ph7_3 is_a: CHEBI:52440 ! cephalosporin carboxylic acid anion [Term] id: CHEBI:58367 name: UDP-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:76533 ! NDP-alpha-D-glucose(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58369 name: dTDP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58370 name: dTTP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58371 name: 2-dehydro-3-deoxy-L-rhamnonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:58372 name: 5-oxo-2,5-dihydro-2-furylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58373 name: 3-hexaprenyl-4,5-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:64694 ! 3,4-dihydroxy-5-polyprenylbenzoate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58374 name: 3-ammoniopropanal subset: chebi_ph7_3 is_a: CHEBI:133427 ! omega-ammonioaldehyde is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58375 name: trans-4-hydroxy-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:58376 name: CMP-N-glycoloyl-beta-neuraminate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58377 name: L-tyrosine methyl ester 4-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:140317 ! phenyl sulfate oxoanion [Term] id: CHEBI:58378 name: 2-dehydro-3-deoxy-D-fuconate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:58379 name: deacetylipecoside(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:58380 name: pseudouridine 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58381 name: 3-ADP-2-phosphoglycerate(5-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58382 name: 5-ammoniopentanamide subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58383 name: phosphonoacetaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:58384 name: cadaverine(2+) subset: chebi_ph7_3 is_a: CHEBI:70977 ! alkane-alpha,omega-diammonium(2+) relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58385 name: luteolin 7-O-beta-D-glucosiduronate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58386 name: (S)-2-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:76724 ! 2-hydroxyoctadecanoate [Term] id: CHEBI:58387 name: 3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:136966 ! 3beta-hydroxysteroid-4alpha-carboxylate [Term] id: CHEBI:58388 name: heparan sulfate alpha-D-glucosaminide polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58389 name: trimethylammonium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:58390 name: N(6')-acetylkanamycin B(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58391 name: all-trans-nonaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:58392 name: alpha-D-glucose 1,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58393 name: aureusidin-6-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58394 name: 7-phospho-2-dehydro-3-deoxy-D-arabino-heptonate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58395 name: myricetin(1-) subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:58396 name: aerobactinate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58398 name: (2S)-2-hydroxyphytanate subset: chebi_ph7_3 is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58123 ! (2S)-2-hydroxy monocarboxylic acid anion [Term] id: CHEBI:58399 name: isopenicillin N(1-) subset: chebi_ph7_3 is_a: CHEBI:51356 ! penicillinate anion [Term] id: CHEBI:58400 name: 2-oxophytanate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:58401 name: 1D-myo-inositol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion is_a: CHEBI:84139 ! myo-inositol phosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58402 name: 5-oxo-L-prolinate subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:58403 name: 3,5,3'-triiodothyropyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:37142 ! organoiodine compound [Term] id: CHEBI:58404 name: (E)-3,7,11,15-tetramethylhexadec-2-en-1-yl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58405 name: ditrans,polycis-undecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:136960 ! ditrans,polycis-polyprenyl diphosphate(3-) is_a: CHEBI:167056 ! polyprenol diphosphate(3-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58406 name: 4-amino-4-deoxychorismate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:58407 name: isoscoparin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58408 name: penicillin N(1-) subset: chebi_ph7_3 is_a: CHEBI:51356 ! penicillinate anion [Term] id: CHEBI:58409 name: alpha-D-mannose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58410 name: 2-amino-5-oxocyclohex-1-enecarbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58411 name: CoM-S-S-CoB(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58412 name: syringetin(1-) subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:58413 name: (R)-6-hydroxynicotinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58414 name: 1D-myo-inositol 1,3,4-trisphosphate(6-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58415 name: deacetoxycephalosporin C(1-) subset: chebi_ph7_3 is_a: CHEBI:52440 ! cephalosporin carboxylic acid anion [Term] id: CHEBI:58416 name: chlorophyll a(1-) subset: chebi_ph7_3 is_a: CHEBI:139291 ! chlorophyll(1-) is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:58418 name: ditrans,polycis-decaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58419 name: 4-hydroxy-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:63137 ! 4-hydroxyproline zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58420 name: cis-5,6-dihydroxy-4-isopropylcyclohexa-1,3-dienecarboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58421 name: 5-amino-6-(5-phosphoribitylamino)uracil(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58422 name: chondroitin 4'-sulfate anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:58423 name: UDP-D-galactofuranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58424 name: 1-(5-phospho-D-ribosyl)-ATP(6-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58425 name: 5-oxo-4,5-dihydro-2-furylacetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:58426 name: N(2)-formyl-N(1)-(5-phospho-D-ribosyl)glycinamide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58427 name: N-acetyl-D-glucosaminyldiphosphodolichol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58429 name: alpha,alpha-trehalose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58430 name: (S)-2-hydroxypropyl-CoM(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:58431 name: jasmonate(1-) subset: chebi_ph7_3 is_a: CHEBI:136184 ! jasmonic acid anion is_a: CHEBI:167055 ! Jasmonate derivatives relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58432 name: histaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58433 name: 1D-myo-inositol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:76301 ! inositol phosphate oxoanion is_a: CHEBI:84139 ! myo-inositol phosphate(2-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58434 name: (2Z,4E)-4-hydroxymuconic semialdehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:71944 ! aldehydic acid anion [Term] id: CHEBI:58435 name: 1-(5-phospho-beta-D-ribosyl)-5-[(5-phospho-beta-D-ribosylamino)methylideneamino]imidazole-4-carboxamide(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58436 name: phosphatidyl-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion [Term] id: CHEBI:58437 name: deamido-NAD(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58438 name: thiaminium carboxylate betaine subset: chebi_ph7_3 is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:58439 name: UDP-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58440 name: quinoline-4-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58441 name: L-2-aminopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:58442 name: pyrroloquinoline quinone(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:58443 name: SAICAR(4-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58444 name: 1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58445 name: anserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:58446 name: 13-hydroxylupaninium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58447 name: isovitexin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58448 name: L-thyroxine zwitterion subset: chebi_ph7_3 is_a: CHEBI:305790 ! thyroxine zwitterion [Term] id: CHEBI:58450 name: adenosine 5'-tetraphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58451 name: pyridoxamine 5'-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:176894 ! vitamin B6 phosphate anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58452 name: 4-(phosphonatooxy)-L-threonine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58453 name: 5-amino-6-(5-phospho-D-ribosylamino)uracil(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58454 name: kynurenate subset: chebi_ph7_3 is_a: CHEBI:38773 ! quinolinemonocarboxylate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58455 name: L-2-aminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:58456 name: 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:147334 ! 1-phosphatidyl-1D-myo-inositol anion derivative is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83191 ! phosphatidylinositol bisphosphate(5-) [Term] id: CHEBI:58457 name: N(1)-(5-phospho-D-ribosyl)glycinamide(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58458 name: (R)-2-hydroxypropyl-CoM(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:58459 name: pyrroloquinoline quinol(3-) is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:50918 ! pyrroloquinoline [Term] id: CHEBI:58460 name: 13-(2-methylcrotonoyloxy)lupaninium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58461 name: 17-O-deacetylvindolinium subset: chebi_ph7_3 is_a: CHEBI:60082 ! vinca alkaloid cation [Term] id: CHEBI:58462 name: 7,8-dihydroneopterin 3'-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58463 name: (7S)-salutaridinol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58464 name: nucleoside 3',5'-cyclic phosphate anion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58465 name: dermatan sulfate polyanion subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:58466 name: 2,3,2',3'-tetrakis(3-hydroxytetradecanoyl)-alpha-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:176343 ! 2,3,2',3'-tetrakis[(3R)-3-hydroxyacyl]-alpha-D-glucosaminyl-1,6-beta-D-glucosamine 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58467 name: 5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58468 name: 3-aminoalanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58469 name: 1D-myo-inositol 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion is_a: CHEBI:84139 ! myo-inositol phosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58470 name: apigenin-7-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58471 name: bis(beta-glucosyluronate)bilirubin subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58472 name: beta-D-mannosyldiacetylchitobiosyldiphosphodolichol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58473 name: codeinone(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58474 name: 3,6-dioxocyclohexa-1,4-dien-1-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58475 name: 5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58476 name: (2S)-2-hydroxy-2-methyl-3-oxobutanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58477 name: N(omega)-phosphonato-L-arginine subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58478 name: 2-formamido-N(1)-(5-O-phosphonato-D-ribosyl)acetamidine subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58479 name: N-formimidoylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58480 name: N-[(R)-pantothenoyl]-L-cysteinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58481 name: (RS)-coclaurinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58482 name: (RS)-norcoclaurinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58483 name: 2-C-methyl-D-erythritol 2,4-cyclic diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58484 name: 1D-myo-inositol 1,2-cyclic phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:58485 name: 3-hydroxy-16-methoxy-2,3-dihydrotabersoninium subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:58487 name: 2'-deoxymugineate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58488 name: 3-epi-3-hydroxymugineate(2-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:58489 name: 5-guanidino-2-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58490 name: (+)-8'-hydroxyabscisate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58495 name: (2S)-2-carbamoylpyrrolidin-1-ium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58496 name: N-acetyl-D-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:58497 name: N-acyl-L-aspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58498 name: 6-acetamido-3-aminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58499 name: L-pyrrolysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58500 name: 7,8-diaminononanoate cation subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58501 name: 7beta-aminocephalosporanic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58502 name: adenosylcobinamide phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58503 name: adenosylcob(III)yrinate a,c-diamide(4-) subset: chebi_ph7_3 is_a: CHEBI:35755 ! pentacarboxylic acid anion [Term] id: CHEBI:58504 name: adenosylcobyrate subset: chebi_ph7_3 is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:58505 name: mugineate(2-) is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:58506 name: Ile(5)-angiotensin II dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58507 name: 3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58509 name: 1-pyrroline-3-hydroxy-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26457 ! 1-pyrrolinecarboxylate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58510 name: UDP-3-O-(3-hydroxytetradecanoyl)-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58511 name: D-erythro-3-methylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58513 name: precorrin-6X(8-) is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58514 name: N(2)-succinyl-L-ornithinate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58515 name: ectoine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58516 name: alpha-D-glucosamine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58517 name: 3,4-dehydrothiomorpholine-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58518 name: precorrin-5(8-) is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58519 name: (E)-2-benzylidenesuccinyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:58520 name: N-succinyl-L-glutamic 5-semialdehyde(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58521 name: trans-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58522 name: precorrin-3B(7-) is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58523 name: (5S)-5-amino-3-oxohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58524 name: gibberellin A1(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58525 name: 5-[(5-phospho-1-deoxy-D-ribulos-1-ylimino)methylamino]-1-(5-phospho-beta-D-ribosyl)imidazole-4-carboxamide(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58526 name: gibberellin A20(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:58527 name: D-ribosylnicotinate subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58528 name: 3-hydroxypropanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58529 name: P(1),P(3)-bis(5'-adenosyl) triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58530 name: gentamycin C1a(5+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58531 name: Se-methyl-L-selenocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58532 name: precorrin-6Y(6-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58533 name: S-methyl-5-thio-alpha-D-ribose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58534 name: 6-phospho-beta-D-galactoside(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58535 name: N(8)-acetylspermidinium(2+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58536 name: hydrogenobyrinic acid a,c-diamide(4-) is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58537 name: cob(II)yrinic acid a,c diamide(4-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58538 name: (R)-3-hydroxy-2-oxo-4-(phosphonatoooxy)butanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58539 name: L-dehydroascorbate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58540 name: (Kdo)2-lipid A(6-) (E. coli) subset: chebi_ph7_3 is_a: CHEBI:176431 ! an alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A(6-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58541 name: 5-methyldeoxycytidine 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58542 name: D-arabino-hex-3-ulose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58543 name: cis-dodec-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58544 name: 3',4',5,7-pentahydroxy-8-methoxyflavon-3-olate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58546 name: cyanidin 3-O-rutinoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:58547 name: N-hydroxy-L-tyrosinate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58548 name: S-methyl-5-thio-D-ribulose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58549 name: kanamycin B(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58550 name: N(1),N(12)-diacetylsperminium(2+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58552 name: N(2')-acetylgentamycin C1a(4+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58553 name: 5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58554 name: gibberellin A44(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:58555 name: S-acetylphosphopantotheine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58556 name: (S)-2-amino-6-oxopimelate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58557 name: N-acetyl-D-mannosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58558 name: N-benzyloxycarbonyl-L-leucinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58560 name: L-alpha-glutamyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58561 name: precorrin-3A(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58562 name: all-cis-5,8,11,14,17-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:61330 ! icosapentaenoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58563 name: (R)-1-ammoniopropan-2-yl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58564 name: 5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate is_a: CHEBI:38466 ! imidazolyl carboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58565 name: 5-hydroxyimidazole-4-acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58566 name: D-arabinitol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58567 name: ajmalinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58570 name: D-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:58571 name: 5-methylbarbituride subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58572 name: N-[(5S)-5-ammonio-5-carboxylatopentanoyl]-L-cysteinyl-D-valinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58573 name: kaempferol oxoanion subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:58574 name: 4-hydroxybutyryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58575 name: cob(I)yrinate a,c diamide(5-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58576 name: 2-deoxy-D-ribofuranose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58577 name: biochanin A 7-O-beta-D-glucoside 6''-O-malonate is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58578 name: UDP-N-acetyl-D-mannosaminouronate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58579 name: beta-D-fructofuranose 2,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58580 name: tetrahydrofolyl-poly(glutamate) macromolecule subset: chebi_ph7_3 is_a: CHEBI:53309 ! polyanionic macromolecule [Term] id: CHEBI:58581 name: precorrin-8X(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58582 name: UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58583 name: 4-acetamidobutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58584 name: 20-hydroxy-leukotriene E4(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58585 name: L-allothreonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:58586 name: 4-hydroxyphenylglyoxylate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:58587 name: gibberellin A19(2-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:58588 name: flavonol oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58589 name: pyridoxine 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:176894 ! vitamin B6 phosphate anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58590 name: gibberellin A3(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58591 name: 3-disulfanyl-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58592 name: 5-amino-1-(5-phosphonato-D-ribosyl)imidazol-3-ium subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58593 name: dCDP(3-) subset: chebi_ph7_3 is_a: CHEBI:73316 ! 2'-deoxyribonucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58594 name: gibberellin A8(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:58595 name: dGDP(3-) subset: chebi_ph7_3 is_a: CHEBI:73316 ! 2'-deoxyribonucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58596 name: coenzyme B(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58599 name: N'-phosphonatoguanidinoethyl methyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58600 name: N(tele)-methylhistaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58601 name: alpha-D-glucose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58602 name: D-mannosyl undecaprenyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58603 name: lipid IVA(4-) subset: chebi_ph7_3 is_a: CHEBI:176425 ! a lipid IVA(4-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:58604 name: L-mimosine(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58605 name: 3''-adenylylstreptomycin(2+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58606 name: synephrinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58607 name: 3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58608 name: 1,2-diacyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57739 ! phosphatidate(2-) is_a: CHEBI:76530 ! sn-glycero-3-monophosphate(2-) [Term] id: CHEBI:58609 name: D-2-ammoniohexano-6-lactam subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58610 name: nocardicin E(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58611 name: (+-)-5-[3-(tert-butylammonio)-2-hydroxypropoxy]-1,2,3,4-tetrahydro-1-naphthol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58612 name: (+-)-5-[3-(tert-butylammonio)-2-hydroxypropoxy]-3,4-dihydronaphthalen-1(2H)-one(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58613 name: 1-(2-carboxylatophenylamino)-1-deoxy-D-ribulose 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58614 name: 2,5-diamino-4-hydroxy-6-(5-phosphonatoribosylamino)pyrimidine(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58616 name: 2-methyl-4-oxo-1,4-dihydroquinolin-3-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58618 name: hydrogenselenophosphate is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:58619 name: S-alkyl thiosulfate anion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:58621 name: dehydroabietate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58622 name: 5alpha,9beta,10alpha-labda-8(20),13-dien-15-yl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58627 name: gibberellin A12(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:58628 name: 5-diphospho-1D-myo-inositol pentakisphosphate(13-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58629 name: N-formyl-L-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58630 name: N-methylanthraniloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58631 name: N(alpha)-gamma-L-glutamylhistamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58632 name: 2,4-divinyl protochlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58633 name: L-homoserine lactone(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58635 name: 5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58636 name: 2-hydroxy-2,3-dihydrogenistein-7-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58637 name: 2-hydroxy-6-oxonona-2,4,7-trienedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58638 name: 4'''-demalonylsalvianin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58639 name: 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58640 name: pelargonidin 3-O-(6-O-caffeoyl-beta-D-glucoside) 5-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:58641 name: N,N-dimethylethanolamine phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58642 name: 2,3-dihydroxy-trans-cinnamate subset: chebi_ph7_3 is_a: CHEBI:36091 ! cinnamates [Term] id: CHEBI:58644 name: p-coumaroylagmatine(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:58645 name: D-allothreonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:58647 name: amidinoproclavaminic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58652 name: N(omega)-phosphohypotaurocyamine(2-) subset: chebi_ph7_3 is_a: CHEBI:22319 ! alkanesulfinate [Term] id: CHEBI:58655 name: (S)-3-aminoisobutyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58658 name: alpha-D-galacturonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:58659 name: 8(R)-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58660 name: CDP-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58661 name: trypanothione disulfide(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58665 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:90390 ! alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) [Term] id: CHEBI:58667 name: (R)-1-pyrroline-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:15893 ! 1-pyrroline-5-carboxylate [Term] id: CHEBI:58668 name: (3S)-citramalyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:57320 ! citramalyl-CoA(5-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58669 name: but-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58670 name: 4-oxoprolinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58671 name: L-3-oxoalaninate is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58672 name: L-2-aminoadipate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58673 name: ADP-D-ribose 2'-phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58674 name: D-fructofuranose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58675 name: O-phosphonato-L-threonine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58677 name: (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:63001 ! 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58678 name: luteolin 7-O-[(beta-D-glucosyluronate)-(1->2)-(beta-D-glucosiduronate)] 4'-O-beta-D-glucosiduronate is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58679 name: 17-O-acetylajmalinium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58680 name: O-phosphonatooxy-D-serine(2-) subset: chebi_ph7_3 is_a: CHEBI:67032 ! O-phosphonatooxyserine(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58681 name: 5-phospho-beta-D-ribosylaminium(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58682 name: 6-hydroxypseudooxynicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58683 name: 3-sulfonatolactate(2-) subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58684 name: 3-epi-3-hydroxy-2'-deoxymugineate subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:58685 name: 3''-deamino-3''-oxonicotianaminium(1-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:58686 name: chlorophyllide b(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58687 name: pheophorbide a(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58688 name: divinyl chlorophyllide a(1-) is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58689 name: (1R,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58690 name: 1,6-anhydro-N-acetyl-beta-muramate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58691 name: (3R,4S,5R)-3,4,5-trihydroxy-6-oxocyclohex-1-en-1-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58692 name: (R)-2-benzylsuccinate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:57621 ! 2-benzylsuccinate(2-) [Term] id: CHEBI:58693 name: (7R)-7-(4-carboxylatobutanamido)cephalosporanate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:52440 ! cephalosporin carboxylic acid anion [Term] id: CHEBI:58694 name: D-tagatofuranose 1,6-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58695 name: D-tagatofuranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58696 name: flaviolin-2-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58697 name: (2R,4S)-2,4-diazaniumylpentanoate subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:58698 name: molybdopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58699 name: L-methioninium (S)-S-oxide residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:5870 name: imidacloprid subset: chebi_ph7_3 is_a: CHEBI:38261 ! imidazolidines is_a: CHEBI:39172 ! monochloropyridine relationship: has_role CHEBI:25540 ! neonicotinoid insectide relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:47958 ! nicotinic acetylcholine receptor agonist relationship: has_role CHEBI:50902 ! genotoxin relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:58700 name: 6-(alpha-D-glucosazaniumyl)-1D-myo-inositol subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58702 name: phosphonatoenolpyruvate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58703 name: 7-ammoniomethyl-7-deazaguanine subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58704 name: 3,3,3-tetraminium(4+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58705 name: N-acetyl-beta-neuraminate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58706 name: L-methioninium (R)-S-oxide residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:58708 name: UDP-4-amino-4-deoxy-beta-L-arabinopyranose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58709 name: UDP-4-deoxy-4-formamido-beta-L-arabinopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58710 name: UDP-beta-L-threo-pentopyranos-4-ulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58711 name: 4-azaniumyl-4-deoxy-alpha-L-arabinopyranosyl undecaprenyl phosphate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58712 name: lipid A(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:58713 name: 7-chloro-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58714 name: beta-L-Ara4N-lipid A(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:58715 name: calcitroate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58716 name: red chlorophyll catabolite(2-) subset: chebi_ph7_3 is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:58717 name: S-substituted L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58718 name: S-substituted N-acetyl-L-cysteinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:58719 name: primary fluorescent chlorophyll catabolite(2-) is_a: CHEBI:38716 ! carboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:58720 name: D-glucopyranuronate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58721 name: N-acetyl-beta-muramate 6-phosphate subset: chebi_ph7_3 is_a: CHEBI:58722 ! N-acetylmuramate 6-phosphate [Term] id: CHEBI:58722 name: N-acetylmuramate 6-phosphate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58723 name: 2-ammonio-2-deoxy-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:65296 ! primary ammonium ion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58724 name: threo-3-methyl-L-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58725 name: 2-ammonio-2-deoxy-D-glucopyranose 6-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58726 name: N-hydroxy-L-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58727 name: N,N-dihydroxy-L-phenylalaninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58728 name: N-hydroxy-L-tryptophanate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58729 name: N,N-dihydroxy-L-tryptophanate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58730 name: 5-carboxylatoamino-1-(5-O-phosphonato-D-ribosyl)imidazole(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58731 name: gamma-L-glutamylputrescinium(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:58732 name: N-[(E)-4-ammoniobutylidene]propane-1,3-diaminium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:35286 ! iminium ion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58733 name: 4-methylene-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58734 name: (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:58735 name: D-mannopyranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:61567 ! D-hexopyranose 6-phosphate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58736 name: (S)-5-oxo-2,5-dihydro-2-furylacetate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:58737 name: (R)-2-O-sulfonatolactate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:58738 name: (R)-3-sulfolactate subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58739 name: 2-aminobut-2-enoate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58741 name: 7(1)-hydroxychlorophyllide a(1-) is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58742 name: pyropheophorbide a anion subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58743 name: 13(2)-carboxypyropheophorbide a(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58744 name: 3-(3,4-dihydroxyphenyl)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:58745 name: UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58746 name: UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-mannuronate subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58747 name: 1D-myo-inositol 1,2,3,5,6-pentakisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:58748 name: N-iminiumylmethyl-L-aspartate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58749 name: 5-deoxy-alpha-D-ribose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58750 name: (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:58752 name: (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:58753 name: ADP-alpha-D-ribose 1''-phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:58754 name: pGpG(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58756 name: 2-trans,6-trans,10-trans-geranylgeranyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57533 ! geranylgeranyl diphosphate(3-) is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58757 name: (9Z,11E,13S,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:58758 name: S-(hydroxymethyl)glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58759 name: 6-phosphonatooxy-D-gluconate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58760 name: demethylsulochrin(1-) is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58761 name: L-2,4-diazaniumylbutyrate subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:58762 name: 7,8-dihydroneopterin 3'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58763 name: N-(3-carboxylatopropanoyl)-L-glutamate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58764 name: (2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58765 name: N-acetyl-L-citrullinate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:58766 name: 4-O-phosphonato-D-erythronate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58767 name: N-acetyl-LL-2,6-diaminopimelate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:58768 name: (1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58769 name: (S)-1-piperideine-6-carboxylate subset: chebi_ph7_3 is_a: CHEBI:16987 ! 1-piperideine-6-carboxylate [Term] id: CHEBI:58770 name: N-acetyl-alpha-neuraminate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58771 name: (R)-2-(carboxylatomethyl)-5-oxo-2,5-dihydro-2-furoate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58772 name: L-methionine (S)-S-oxide zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58773 name: L-methionine (R)-S-oxide zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58774 name: 3-dehydro-L-gulonate 6-phosphate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58775 name: 3-oxo-3-ureidopropanoate subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion [Term] id: CHEBI:58776 name: 2-formylglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58777 name: 2-hydroxymethylglutarate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58778 name: 6-(2-azaniumyl-2-carboxylatoethyl)-7,8-dioxo-1,2,3,4,7,8-hexahydroquinoline-2,4-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:58779 name: CDP-choline(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58780 name: 2,6-dihydroxynicotinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58781 name: (4R)-2-acetyl-4-(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)-4-methyl-3-oxocyclohexa-1,5-dien-1-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58782 name: D-dopachrome(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58783 name: 2-hydroxy-3-methylacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58784 name: 2-hydroxy-3-methylhexadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:58785 name: 2,3-dihydroxy-2,3-dihydrobenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58786 name: cis-3,4-didehydroadipoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:58787 name: cis-3,4-didehydroadipoyl-CoA semialdehyde(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58790 name: 3-(1-carboxylatovinyloxy)anthranilate subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:58792 name: 2-azaniumyl-2-deoxyisochorismate subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:58793 name: 2-O-sinapoyl-D-glucarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58794 name: (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2-) subset: chebi_ph7_3 is_a: CHEBI:133294 ! oxo dicarboxylic acid dianion [Term] id: CHEBI:58795 name: 1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58796 name: (9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58797 name: (S,S)-9,10-dihydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:58798 name: N-(6-aminohexanoyl)-6-aminohexanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58799 name: (2S)-2-\{[(1R)-1-carboxylatoethyl]azaniumyl}pentanoate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58800 name: 4-(L-gamma-glutamylamino)butanoate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58801 name: 3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58802 name: 5-amino-2-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58803 name: 7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:58804 name: 12alpha-hydroxy-3-oxochola-4,6-dien-24-oate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:58805 name: c-di-GMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58806 name: ascopyrone M(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58807 name: ascopyrone P(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58808 name: 5beta-scymnol sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:58809 name: 3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-yl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:58810 name: deoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138842 ! 3alpha-hydroxy bile acid CoA thioester(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58811 name: phenylglyoxylyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58812 name: sophoraflavanone B(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58813 name: leachianone G(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58815 name: 5-methylthio-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:133493 ! omega-(methylthio)-2-oxocarboxylate [Term] id: CHEBI:58816 name: 2-(2-methylthioethyl)malate(2-) subset: chebi_ph7_3 is_a: CHEBI:133494 ! 2-(omega-methylthio)alkylmalate(2-) [Term] id: CHEBI:58817 name: 2-(3-methylthiopropyl)malate(2-) subset: chebi_ph7_3 is_a: CHEBI:133494 ! 2-(omega-methylthio)alkylmalate(2-) [Term] id: CHEBI:58818 name: (1R,2S,5S,6S)-2-(3-carboxylatopropanoyl)-5-[(1-carboxylatovinyl)oxy]-6-hydroxycyclohex-3-ene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58819 name: (R,R)-chrysanthemyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58820 name: lavandulyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58821 name: terpentedienyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58822 name: tuberculosinyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58824 name: sulfonatoacetate subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58825 name: (R)-beta-alanopine(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58826 name: N-acetyl-beta-D-glucosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57513 ! N-acetyl-D-glucosamine 6-phosphate(2-) [Term] id: CHEBI:58827 name: precorrin-2(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:58828 name: 5-(methylsulfanyl)-2,3-dioxopentyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58830 name: (2S)-2-hydroxy-3-oxobutyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58831 name: iminoaspartate is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:61336 ! C4-dicarboxylate [Term] id: CHEBI:58832 name: dihomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58833 name: trihomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58834 name: tetrahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58835 name: pentahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58836 name: hexahomomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58837 name: 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138140 ! 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58838 name: CDP-2,3-bis-O-(geranylgeranyl)-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58839 name: N(6)-dihydrolipoyl-L-lysinium(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:58840 name: N-hydroxydihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58841 name: N-hydroxytrihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58842 name: N-hydroxytetrahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58843 name: N-hydroxypentahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58844 name: N-hydroxyhexahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:58845 name: N,N-dihydroxyhexahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58846 name: N,N-dihydroxydihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58847 name: N,N-dihydroxytrihomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58848 name: N,N-dihydroxytetrahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58849 name: N,N-dihydroxypentahomomethioninate subset: chebi_ph7_3 is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:58850 name: (3S)-3-hydroxy-L-asparagine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58851 name: 2-methyl-3-oxosuccinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58852 name: 5-deoxy-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58853 name: (2S,3S)-2-methylcitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58854 name: 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58855 name: secondary aliphatic ammonium ion subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion [Term] id: CHEBI:58856 name: 2,3-trans-enoyl CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58858 name: N-(3-acetamidopropyl)-4-ammoniobutanal subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58859 name: 2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58860 name: hydroxypyruvaldehyde phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58861 name: 1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58862 name: N(2)-(3-carboxylatopropionyl)-L-citrullinate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58863 name: futalosinate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:58864 name: dehypoxanthine futalosinate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:58865 name: N-carbamoyl-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:58866 name: (1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58868 name: 3,7-dideoxy-D-threo-hepto-2,6-diuolosonate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:58869 name: N-(3-ammoniopropyl)-4-ammoniobutanal subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58870 name: beta-D-fructofuranosyl alpha-D-mannopyranoside 6(F)-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58871 name: 3,3'-biflaviolin 2,2'-diolate is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58872 name: 3,8'-biflaviolin 2,2'-diolate is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:58874 name: taurohyocholate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:58875 name: hyodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58876 name: murideoxycholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58877 name: glycochenodeoxycholate 7-sulfate(2-) subset: chebi_ph7_3 is_a: CHEBI:133720 ! glycochenodeoxycholic acid sulfate anion is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:58878 name: 2-oxo-1,2-dihydroquinoline-4-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58879 name: N-acetylphosphinothricin(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58881 name: N-acetyl-D-hexosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58882 name: phosphinothricin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58883 name: flavonolate 7-O-beta-D-glucoside is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58884 name: (2R)-homocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58885 name: UDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:138068 ! ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) is_a: CHEBI:140359 ! UDP-monosaccharide(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:76533 ! NDP-alpha-D-glucose(2-) [Term] id: CHEBI:58886 name: 1D-myo-inositol 2-ammonio-2-deoxy-alpha-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58887 name: 1D-myo-inositol 2-(L-cysteiniumylamino)-2-deoxy-alpha-D-glucopyranoside subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58890 name: 2,5-diamino-6-(1-D-ribitylamino)pyrimidin-4(3H)-one 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58891 name: 6-(alpha-D-glucosaminyl)-1D-myo-inositol 1,2-cyclic phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:58892 name: 1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:58893 name: precorrin-1(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:58894 name: cob(II)yrinate(6-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:58895 name: 2-carboxylato-4-methyl-5-[(2-phosphonatooxy)ethylidene]-2,5-dihydrothiazole(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58896 name: 2-hydroxy carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:58897 name: 1,4-dihydroxy-2-naphthoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:58898 name: 2-azaniumyl-4,5-dihydroxy-6-oxo-7-(phosphonatooxy)heptanoate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58899 name: alpha-D-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58900 name: UDP-2-acetamido-2-deoxy-D-glucuronate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58901 name: 2-(E)-O-feruloyl-D-galactarate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:58902 name: beta-L-aspartylhydroxamic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58903 name: Delta(11)-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77632 ! unsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:58905 name: S-sulfanylglutathionate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:58906 name: sphingosine-1-phosphocholine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:85171 ! sphingoid-1-phosphocholine(1+) [Term] id: CHEBI:58907 name: precursor Z(2-) is_a: CHEBI:58944 ! dialkyl phosphate anion [Term] id: CHEBI:58908 name: L-galactose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58909 name: 4-deoxy-4-formamido-alpha-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58910 name: thyroxine sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:140317 ! phenyl sulfate oxoanion is_a: CHEBI:60308 ! 3,3',5-triiodo-L-thyroninate [Term] id: CHEBI:58911 name: delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-beta-D-glucoside(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58912 name: ternatin C5(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58913 name: delphinidin-5-olate 3-O-(6''-O-carboxylatoacetyl)-beta-D-glucoside-3'-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58914 name: all-trans-polyprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58915 name: (2E)-but-2-ene-1,2,3-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:58916 name: (R)-piperazin-4-ium-2-carboxamide(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58917 name: (R)-piperazine-2-carboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58918 name: beta-alaninium amide subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:58919 name: (S)-piperazin-4-ium-2-carboxamide(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58920 name: (S)-piperazine-2-carboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58921 name: N-acyl-L-homoserinate subset: chebi_ph7_3 is_a: CHEBI:58947 ! N-acylhomoserinate [Term] id: CHEBI:58922 name: Ile(5)-angiotensin II (1-7) dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58923 name: lipoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58924 name: isopimarate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:58925 name: kaempferide(1-) subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:58927 name: L-lupinic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58928 name: N-formimidoyl-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:58929 name: N(4)-acetyl-L-2,4-diaminobutyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:58930 name: 16-methoxytabersoninium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:58931 name: oxalatosuccinate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:58933 name: propanoyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58934 name: 2,2'-iminodipropanoate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:58935 name: 2,4-diazaniumylpentanoate subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:58936 name: 2,4-dihydroxyhept-2-enedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:58937 name: thiamine(1+) diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:58938 name: thiamine(1+) triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:26948 ! vitamin B1 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:58939 name: 2-(1-hydroxyethyl)thiamine diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58941 name: cyclic tetrapyrrole anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:58942 name: amino-acid cation residue is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:58943 name: alpha-amino-acid cation residue is_a: CHEBI:58942 ! amino-acid cation residue [Term] id: CHEBI:58944 name: dialkyl phosphate anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58945 name: organophosphate oxoanion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:26079 ! phosphoric acid derivative [Term] id: CHEBI:58946 name: acyl-CoA oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:58947 name: N-acylhomoserinate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:58948 name: aryl(methyl)malonate(1-) is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:58950 name: very long-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:58951 name: short-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:58953 name: saturated fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:58954 name: straight-chain saturated fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:58955 name: branched-chain fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:58956 name: branched-chain saturated fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion is_a: CHEBI:58955 ! branched-chain fatty acid anion [Term] id: CHEBI:58958 name: organosulfate oxoanion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:58961 name: N-arachidonoylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:29348 ! fatty amide [Term] id: CHEBI:589779 name: piperidinium subset: chebi_ph7_3 is_a: CHEBI:137419 ! secondary ammonium ion [Term] id: CHEBI:59002 name: N-arachidonoylglycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59062 name: polymyxin is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:46895 ! lipopeptide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:59080 name: N-\{alpha-Glc-(1->3)-alpha-Man-(1->2)-alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->6)]-alpha-Man-(1->6)]-beta-Man-(1->4)-beta-GlcNAc-(1->4)-beta-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:192714 ! an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:59082 name: N-\{alpha-Glc-(1->3)-alpha-Glc-(1->3)-alpha-Man-(1->2)-alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->6)]-alpha-Man-(1->6)]-beta-Man-(1->4)-beta-GlcNAc-(1->4)-beta-GlcNAc}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:192714 ! an N(4)-(oligosaccharide-(1->3)-[oligosaccharide-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc)-L-asparaginyl residue is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:59087 name: N-\{alpha-Man-(1->3)-[alpha-Man-(1->3)-[alpha-Man-(1->6)]-alpha-Man-(1->6)]-beta-Man-(1->4)-beta-GlcNAc-(1->4)-beta-GlcNac}-L-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:59107 name: EC 3.4.24.* (metalloendopeptidase) inhibitor is_a: CHEBI:37670 ! protease inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:59108 name: N(4)-glycosylated L-asparagine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:59132 name: antigen is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:59137 name: (8xi)-cinchonan is_a: CHEBI:26513 ! quinolines [Term] id: CHEBI:59138 name: (8S)-cinchonan is_a: CHEBI:59137 ! (8xi)-cinchonan [Term] id: CHEBI:59139 name: gibberellin carboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:59140 name: precorrin carboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:59163 name: biomarker is_a: CHEBI:47867 ! indicator [Term] id: CHEBI:59174 name: hapten is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:59193 name: 2-iminio-3-(indol-3-yl)propanoate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:59194 name: 2-iminio-3-(7-chloroindol-3-yl)propionate subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:59195 name: 7-chloro-alpha,beta-didehydrotryptophan is_a: CHEBI:145326 ! 2,3-dehydroamino acid [Term] id: CHEBI:59196 name: dichlorochromopyrrolic acid is_a: CHEBI:52508 ! chloroindole is_a: CHEBI:59197 ! pyrroledicarboxylic acid [Term] id: CHEBI:59197 name: pyrroledicarboxylic acid is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:59198 name: dichlorochromopyrrolate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:59202 name: straight-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:59203 name: straight-chain fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:59210 name: alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-beta-D-Glcp is_a: CHEBI:22160 ! acetamides is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:59412 ! amino tetrasaccharide [Term] id: CHEBI:59216 name: beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:132814 ! beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-beta-D-Galp-(1->4)-D-Glcp is_a: CHEBI:22484 ! galactosamine oligosaccharide is_a: CHEBI:59412 ! amino tetrasaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:59226 name: N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucose is_a: CHEBI:151472 ! N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:59237 name: phenolic phthiocerol subset: chebi_ph7_3 is_a: CHEBI:189847 ! phthiocerol derivatives is_a: CHEBI:27136 ! triol is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:59238 name: cyclic fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:5924 name: EC 3.4.21.* (serine endopeptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:59240 name: phthiocerol A subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:189847 ! phthiocerol derivatives relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:59252 name: linear tetrapyrrole anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:59258 name: N-hydroxy-alpha-amino-acid anion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:59266 name: amino trisaccharide is_a: CHEBI:22483 ! amino oligosaccharide is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:59268 name: amino pentasaccharide is_a: CHEBI:22483 ! amino oligosaccharide is_a: CHEBI:63566 ! pentasaccharide derivative [Term] id: CHEBI:59270 name: 2-hydroxymyristic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:59271 name: gamma-D-glutamyl-meso-diaminopimelic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:27093 ! tricarboxylic acid is_a: CHEBI:83983 ! D-glutamic acid derivative relationship: has_role CHEBI:194467 ! NOD1 agonist [Term] id: CHEBI:59294 name: alpha-L-Fucp-(1->3)-[beta-D-Galp-(1->4)]-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide is_a: CHEBI:62287 ! alpha-L-Fucp-(1->3)-[beta-D-Galp-(1->4)]-D-GlcpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:59295 name: beta-D-Galp-(1->3)-[alpha-L-Fucp-(1->4)]-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:62265 ! beta-D-Galp-(1->3)-[alpha-L-Fucp-(1->4)]-D-GlcpNAc [Term] id: CHEBI:59296 name: alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:62259 ! alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)-D-GlcpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:59314 name: alpha-D-Galp-(1->4)-beta-D-Galp subset: chebi_ph7_3 is_a: CHEBI:546808 ! alpha-D-Gal-(1->4)-D-Gal [Term] id: CHEBI:59326 name: prostaglandin carboxylic acid anion is_a: CHEBI:28868 ! fatty acid anion is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:59338 name: methylammonium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59345 name: 5,6,7,8-tetrahydrosarcinapterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:59350 name: 2-hydroxychromene-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:38674 ! chromenemonocarboxylate [Term] id: CHEBI:59352 name: chromenemonocarboxylic acid is_a: CHEBI:23232 ! chromenes is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:59353 name: (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:59354 name: (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:59356 name: 7-(3-methylbut-2-enyl)-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:59359 name: hexacarboxylic acid is_a: CHEBI:33575 ! carboxylic acid [Term] id: CHEBI:59360 name: hexacarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:59386 name: 2-O-(alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol is_a: CHEBI:59466 ! phosphatidylinositol mannoside relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:59399 name: glutathione amide is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:35735 ! dicarboxylic acid monoamide is_a: CHEBI:47923 ! tripeptide [Term] id: CHEBI:59403 name: glutathione amide disulfide is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:59410 name: 3-epi-6-deoxocathasterone subset: chebi_ph7_3 is_a: CHEBI:188921 ! C28-steroid is_a: CHEBI:188922 ! (22S)-22-hydroxy C28-steroid is_a: CHEBI:22921 ! brassinosteroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid [Term] id: CHEBI:59411 name: (5alpha,22S,24R)-22-hydroxyergostan-3-one subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:22921 ! brassinosteroid is_a: CHEBI:36863 ! 22-hydroxy steroid [Term] id: CHEBI:59412 name: amino tetrasaccharide is_a: CHEBI:22483 ! amino oligosaccharide is_a: CHEBI:63567 ! tetrasaccharide derivative [Term] id: CHEBI:59414 name: muramyl dipeptide is_a: CHEBI:24396 ! glycopeptide relationship: has_role CHEBI:50847 ! immunological adjuvant [Term] id: CHEBI:59418 name: 15beta-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:38090 ! 15beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:59433 name: 2-phospho-L-lactate is_a: CHEBI:38716 ! carboxylic acid dianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59435 name: L-lactyl-2-diphospho-5'-guanosine(3-) subset: chebi_ph7_3 is_a: CHEBI:38717 ! carboxylic acid trianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59436 name: L-lactyl-2-diphospho-5'-guanosine is_a: CHEBI:24458 ! guanosines is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:59457 name: 1-(5-phosphonato-beta-D-ribosyl)-5'-AMP(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:59458 name: N-[(R)-4-phosphonatopantothenoyl]-L-cysteinate(3-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59466 name: phosphatidylinositol mannoside is_a: CHEBI:24410 ! glycosylphosphatidylinositol relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:59475 name: 6-O-acyl-D-glucose is_a: CHEBI:167109 ! acyl sugars is_a: CHEBI:52782 ! O-acyl carbohydrate is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:59497 name: beta-D-galactofuranose subset: chebi_ph7_3 is_a: CHEBI:143624 ! D-galactofuranose [Term] id: CHEBI:59505 name: 2-hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59513 name: monodehydro-L-ascorbate(1-) subset: chebi_ph7_3 is_a: CHEBI:36877 ! organic radical anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59517 name: DNA synthesis inhibitor is_a: CHEBI:76932 ! pathway inhibitor [Term] id: CHEBI:59524 name: lipoarabinomannan is_a: CHEBI:24410 ! glycosylphosphatidylinositol relationship: has_role CHEBI:59132 ! antigen relationship: has_role CHEBI:72316 ! virulence factor [Term] id: CHEBI:59531 name: F420-0(2-) is_a: CHEBI:26544 ! rhamnonate is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:59535 ! pyrimidoquinolines [Term] id: CHEBI:59532 name: F420-0 is_a: CHEBI:16648 ! dialkyl phosphate is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:59535 ! pyrimidoquinolines [Term] id: CHEBI:59535 name: pyrimidoquinolines is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:59536 name: coenzyme F420-1 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:59537 name: coenzyme alpha-F420-3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:595389 name: 4'-demethylrebeccamycin subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:51914 ! organic heterohexacyclic compound is_a: CHEBI:51915 ! indolocarbazole [Term] id: CHEBI:59539 name: coenzyme alpha-F420-3(5-) is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:59541 name: coenzyme gamma-F420-2(4-) is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:59543 name: coenzyme F420-1(3-) is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:59535 ! pyrimidoquinolines relationship: has_role CHEBI:23354 ! coenzyme [Term] id: CHEBI:59544 name: phosphoantigen is_a: CHEBI:59132 ! antigen [Term] id: CHEBI:59545 name: 2,5-diamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59546 name: 2,5-diamino-6-(1-D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:38338 ! aminopyrimidine [Term] id: CHEBI:59549 name: essential fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid [Term] id: CHEBI:59554 name: medium-chain fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:59558 name: medium-chain fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:59560 name: sapropterin subset: chebi_ph7_3 is_a: CHEBI:15372 ! 5,6,7,8-tetrahydrobiopterin relationship: has_role CHEBI:23354 ! coenzyme relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:33295 ! diagnostic agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59561 name: diamino acid anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:59562 name: 5-hydroxyisouric acid anion subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine is_a: CHEBI:30848 ! urate(1-) [Term] id: CHEBI:59564 name: thermospermine is_a: CHEBI:39166 ! tetramine is_a: CHEBI:39474 ! polyazaalkane [Term] id: CHEBI:59573 name: (1->2)-beta-D-mannan subset: chebi_ph7_3 is_a: CHEBI:28808 ! mannan [Term] id: CHEBI:59595 name: arabinofuranosyl group is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:59633 name: mycothiol S-conjugate subset: chebi_ph7_3 is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:59635 name: organophosphonate oxoanion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:36360 ! phosphorus oxoacids and derivatives [Term] id: CHEBI:59640 name: N-acetylglucosamine is_a: CHEBI:21638 ! N-acylglucosamine relationship: has_role CHEBI:78366 ! EC 2.7.1.1 (hexokinase) inhibitor [Term] id: CHEBI:59643 name: thia fatty acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:59644 name: oxo fatty acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:59647 name: EC 2.3.1.50 (serine C-palmitoyltransferase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:59648 name: precursor Z(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion [Term] id: CHEBI:59650 name: amino fatty acid is_a: CHEBI:32952 ! amine is_a: CHEBI:33709 ! amino acid is_a: CHEBI:60690 ! nitrogen-containing fatty acid [Term] id: CHEBI:59651 name: arseno-mycothiol is_a: CHEBI:22632 ! arsenic molecular entity [Term] id: CHEBI:59653 name: arseno-mycothiol(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:59655 name: arseno-mycothiol(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:59683 name: antipruritic drug is_a: CHEBI:50177 ! dermatologic drug [Term] id: CHEBI:59685 name: edaxadiene subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:59686 ! halimane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:59686 name: halimane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:59687 name: halimane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent [Term] id: CHEBI:59696 name: steroid sulfate oxoanion is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:59698 name: phosphoric acids is_a: CHEBI:33457 ! phosphorus oxoacid [Term] id: CHEBI:59699 name: N,N-dihydroxy-alpha-amino-acid anion is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:59720 name: HPETE anion subset: chebi_ph7_3 is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:59724 name: ribonucleoside triphosphate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:597326 name: pyridoxal 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:176894 ! vitamin B6 phosphate anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59737 name: nucleotide-sugar oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59739 name: electrophilic reagent is_a: CHEBI:33893 ! reagent is_a: CHEBI:39143 ! Lewis acid [Term] id: CHEBI:59740 name: nucleophilic reagent is_a: CHEBI:33893 ! reagent is_a: CHEBI:39144 ! Lewis base [Term] id: CHEBI:5975 name: iron chelate is_a: CHEBI:33892 ! iron coordination entity [Term] id: CHEBI:59758 name: omega-amino fatty acid is_a: CHEBI:59650 ! amino fatty acid [Term] id: CHEBI:59765 name: boric acids is_a: CHEBI:33145 ! boron oxoacid relationship: has_role CHEBI:138103 ! inorganic acid [Term] id: CHEBI:59768 name: aliphatic aldehyde is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:59769 name: acetal is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:59770 name: cyclic acetal is_a: CHEBI:24532 ! organic heterocyclic compound is_a: CHEBI:59769 ! acetal [Term] id: CHEBI:59772 name: hemiketal subset: chebi_ph7_3 is_a: CHEBI:5653 ! hemiacetal [Term] id: CHEBI:59776 name: D-glyceraldehyde 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59777 name: ketal is_a: CHEBI:59769 ! acetal [Term] id: CHEBI:59779 name: cyclic ketal is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:59777 ! ketal [Term] id: CHEBI:59780 name: cyclic hemiketal is_a: CHEBI:38131 ! lactol is_a: CHEBI:59772 ! hemiketal [Term] id: CHEBI:59783 name: 2-hydroxy-4-methylvaleric acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:59786 name: thioaldehyde is_a: CHEBI:50492 ! thiocarbonyl compound [Term] id: CHEBI:59789 name: S-adenosyl-L-methionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:59791 name: gibberellin A3 O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:59792 name: thioacetal is_a: CHEBI:33261 ! organosulfur compound [Term] id: CHEBI:59793 name: monothioacetal subset: chebi_ph7_3 is_a: CHEBI:59792 ! thioacetal [Term] id: CHEBI:598 name: 1-alkyl-2-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:24353 ! glycerol ether is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76578 ! diradylglycerol [Term] id: CHEBI:59806 name: (S)-nicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:59807 name: (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:59809 name: docetaxel trihydrate is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35505 ! hydrate relationship: has_part CHEBI:4672 ! docetaxel anhydrous relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:59814 name: L-alpha-amino acid anion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:59815 name: 2,3,5,6-tetrachlorophenolate subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:59825 name: CMP-3-deoxy-alpha-D-manno-octulosonate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:59826 name: progestin is_a: CHEBI:50745 ! progestogen [Term] id: CHEBI:59835 name: hydroxy fatty acid anion is_a: CHEBI:28868 ! fatty acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:59836 name: oxo fatty acid anion is_a: CHEBI:28868 ! fatty acid anion is_a: CHEBI:35903 ! oxo carboxylic acid anion [Term] id: CHEBI:59845 name: 3-hydroxy fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid [Term] id: CHEBI:59848 name: thia fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:59863 name: D-fructofuranuronate subset: chebi_ph7_3 is_a: CHEBI:16849 ! D-fructuronate [Term] id: CHEBI:59864 name: depigmentation drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:59869 name: L-alpha-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:78608 ! alpha-amino acid zwitterion [Term] id: CHEBI:59871 name: D-alpha-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:59872 name: heptaketide is_a: CHEBI:26188 ! polyketide [Term] id: CHEBI:59874 name: N-acyl-L-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:59876 name: N-acyl-D-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:59879 name: (24E)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:59881 name: keto-D-fructuronate subset: chebi_ph7_3 is_a: CHEBI:16849 ! D-fructuronate [Term] id: CHEBI:59885 name: XTP(3-) is_a: CHEBI:53012 ! xanthosine 5'-phosphate is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:59887 name: 2-imino-3-(7-chloroindol-3-yl)propionate(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:59888 name: gamma-aminobutyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:59889 name: ureidoperacrylic acid subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas is_a: CHEBI:52094 ! peroxy acid [Term] id: CHEBI:59890 name: ureidoacrylic acid is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:59891 name: ureidoacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:59892 name: (Z)-3-aminoperacrylic acid subset: chebi_ph7_3 is_a: CHEBI:47989 ! enamine is_a: CHEBI:52094 ! peroxy acid [Term] id: CHEBI:59893 name: (Z)-3-aminoacrylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:59894 name: (Z)-3-aminoacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:59895 name: glutathione amide zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:59896 name: glutathione amide disulfide dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:35489 ! organic disulfide [Term] id: CHEBI:59897 name: EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor is_a: CHEBI:22587 ! antiviral agent is_a: CHEBI:38234 ! DNA polymerase inhibitor [Term] id: CHEBI:59898 name: 3-iodo-L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:59899 name: 3-nitropropanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:59903 name: thermosperminium(4+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:59904 name: 7,8-didemethyl-8-hydroxy-5-deazariboflavin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:59905 name: dopaminium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59906 name: 2-phosphonato-L-lactate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59907 name: F420-0(3-) subset: chebi_ph7_3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59908 name: ecgoninium methyl ester(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:59910 name: N-acetyl-beta-D-glucosaminyl-(1->4)-D-glucosaminium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:59911 name: N-formylmaleamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:59913 name: thio-fatty acid is_a: CHEBI:33576 ! sulfur-containing carboxylic acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:59914 name: thio fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:59916 name: methylmalonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:59917 name: 4-O-phosphohygromycin B(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:59918 name: acyl monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59920 name: coenzyme F420-1(4-) subset: chebi_ph7_3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:59922 name: N-acetyl-beta-D-glucosaminyl-(1->4)-D-glucosamine is_a: CHEBI:50674 ! chitobioses [Term] id: CHEBI:59923 name: coenzyme alpha-F420-3(6-) subset: chebi_ph7_3 is_a: CHEBI:26554 ! ribitol phosphate is_a: CHEBI:35754 ! tetracarboxylic acid anion [Term] id: CHEBI:59924 name: 5,6,7,8-tetrahydrosarcinapterin(4-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59930 name: N-formylmaleamic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:59945 name: (S)-2-ureidoglycine is_a: CHEBI:16282 ! 2-ureidoglycine [Term] id: CHEBI:59947 name: (S)-2-ureidoglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:57714 ! 2-ureidoglycine zwitterion [Term] id: CHEBI:59948 name: columbianetin subset: chebi_ph7_3 is_a: CHEBI:24128 ! furanocoumarin is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:59950 name: neopinone(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:59953 name: thebaine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:59955 name: D-glycero-D-manno-heptose 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:35157 ! aldoheptose phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59957 name: D-glycero-D-manno-heptose 1,7-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:35157 ! aldoheptose phosphate is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59958 name: (3S,6E)-nerolidol subset: chebi_ph7_3 is_a: CHEBI:141283 ! (6E)-nerolidol [Term] id: CHEBI:59959 name: (3R,6E)-nerolidol subset: chebi_ph7_3 is_a: CHEBI:141283 ! (6E)-nerolidol relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:59961 name: alpha-selinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:49272 ! selinene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:59964 name: imidazolium ion is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:59966 name: ADP-D-glycero-beta-D-manno-heptose is_a: CHEBI:16693 ! ADP-D-glycero-D-manno-heptose [Term] id: CHEBI:59967 name: ADP-D-glycero-beta-D-manno-heptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:59969 name: GDP-D-glycero-alpha-D-manno-heptose is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:59971 name: GDP-D-glycero-alpha-D-manno-heptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:59976 name: 3'-O-methyltricetin is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38684 ! tetrahydroxyflavone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:59979 name: 3',5'-di-O-methyltricetin is_a: CHEBI:138730 ! 3'-methoxyflavones is_a: CHEBI:23798 ! dimethoxyflavone is_a: CHEBI:27116 ! trihydroxyflavone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor [Term] id: CHEBI:59985 name: beta-D-glucosyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:59988 name: alpha-tyvelopyranose subset: chebi_ph7_3 is_a: CHEBI:30943 ! tyvelose [Term] id: CHEBI:59990 name: N,N-dimethyl-4-nitrosoaniline subset: chebi_ph7_3 is_a: CHEBI:23806 ! dimethylaniline is_a: CHEBI:35800 ! nitroso compound is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:59991 name: 4-(hydroxylamino)-N,N-dimethylaniline subset: chebi_ph7_3 is_a: CHEBI:23806 ! dimethylaniline is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:59996 name: 1,2-diacyl-sn-glycerol 3-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:59997 name: EC 1.14.18.1 (tyrosinase) inhibitor is_a: CHEBI:76845 ! EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor [Term] id: CHEBI:59998 name: 1,2-diacyl-sn-glycerol 3-diphosphate is_a: CHEBI:26706 ! sn-glycerol 3-phosphates [Term] id: CHEBI:59999 name: chemical substance is_a: CHEBI:24431 ! chemical entity [Term] id: CHEBI:60000 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphocholine betaine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:60001 name: pelargonidin 3-O-rutinoside 5-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:60002 name: D-glycero-D-manno-heptose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:35157 ! aldoheptose phosphate [Term] id: CHEBI:60004 name: mixture is_a: CHEBI:59999 ! chemical substance [Term] id: CHEBI:60005 name: 3-amino-4-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate is_a: CHEBI:63473 ! aromatic amino-acid anion [Term] id: CHEBI:60006 name: laricitrin(1-) subset: chebi_ph7_3 is_a: CHEBI:58588 ! flavonol oxoanion [Term] id: CHEBI:60007 name: sulfoglycolithocholate(2-) subset: chebi_ph7_3 is_a: CHEBI:132924 ! sulfoglycolithocholate anion is_a: CHEBI:57670 ! N-acylglycinate is_a: CHEBI:59696 ! steroid sulfate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60008 name: glycolithocholate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60009 name: UDP-6-sulfoquinovose(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:60014 name: 3'-O-methyltricetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:60015 name: 2,3-dehydroacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:60016 name: 3',5'-di-O-methyltricetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:60020 name: 3',4',5'-O-trimethyltricetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:60023 name: CoA-glutathione(5-) subset: chebi_ph7_3 is_a: CHEBI:35489 ! organic disulfide is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60025 name: (5Z,7E,9E,14Z,17Z)-icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:60027 name: polymer is_a: CHEBI:60004 ! mixture relationship: has_part CHEBI:33839 ! macromolecule [Term] id: CHEBI:60029 name: homopolymer is_a: CHEBI:60027 ! polymer relationship: has_part CHEBI:37997 ! homopolymer macromolecule [Term] id: CHEBI:60032 name: undecaprenyldiphosphonato-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysyl-D-alanyl-D-alanine(3-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:60033 name: lipid II(3-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:60038 name: flavonoid oxoanion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:60039 name: L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60040 name: alpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:136398 ! N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactoside(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:60041 name: cis-3-hydroxy-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60043 name: 5'-acylphosphoadenosine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60045 name: tricetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:60047 name: N-acetyl-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60048 name: pelargonidin 3-O-rutinoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:60049 name: cobalt-sirohydrochlorin(8-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60050 name: estrone 3-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60051 name: N-formyl-D-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60052 name: siroheme(8-) subset: chebi_ph7_3 is_a: CHEBI:30413 ! heme is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:600520 name: micafungin is_a: CHEBI:57248 ! echinocandin is_a: CHEBI:87113 ! antibiotic antifungal drug relationship: has_role CHEBI:35441 ! antiinfective agent [Term] id: CHEBI:60053 name: cobalt-precorrin-2(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60055 name: dermatan 6'-sulfate anion subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:60056 name: cocaine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:37332 ! tropane alkaloid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60057 name: N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-D-glucosaminyl undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60058 name: S-acylglutathionate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:60059 name: dermatan anion subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:60060 name: cobalt-precorrin-3(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60061 name: cobalt-precorrin-4(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60062 name: cobalt-precorrin-5A(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60063 name: cobalt-precorrin-5B(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60064 name: cobalt-precorrin-6A(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:60065 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:79210 ! alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(1-) is_a: CHEBI:88071 ! monosialodiglycosylceramide(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60073 name: N-acylneuraminate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:62944 ! sialic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:60076 name: 6-O-sinapoyl-D-glucono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:24267 ! gluconolactone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:60077 name: luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] is_a: CHEBI:25091 ! luteolin O-glucuronoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:60078 name: 4-O-feruloyl-D-quinate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:60079 name: alpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:136398 ! N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactoside(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:60080 name: O-phosphoviomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:60195 ! cyclic peptide cation is_a: CHEBI:60196 ! O-phospho peptide cation [Term] id: CHEBI:60081 name: viomycin(3+) subset: chebi_ph7_3 is_a: CHEBI:60195 ! cyclic peptide cation relationship: has_role CHEBI:33231 ! antitubercular agent [Term] id: CHEBI:60082 name: vinca alkaloid cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:60083 name: galactitol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60084 name: D-glucitol 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60085 name: phosphoethanolamine-Kdo2-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:60086 name: lipid A oxoanion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:60087 name: 3-(cis-5,6-dihydroxycyclohexa-1,3-dienyl)propanoate subset: chebi_ph7_3 is_a: CHEBI:23469 ! cyclohexadienediol is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:60090 name: 7-hydroxyflavon-3-olate is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:60091 name: alpha,alpha-trehalose-2-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:60092 name: SL659 subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:60117 ! trehalose sulfate is_a: CHEBI:62552 ! polyacyl alpha,alpha-trehalose derivative [Term] id: CHEBI:60096 name: poly(glycerol phosphate) is_a: CHEBI:60029 ! homopolymer relationship: has_part CHEBI:15943 ! poly(glycerol phosphate) macromolecule [Term] id: CHEBI:60101 name: UDP-2-acetamido-2,6-dideoxy-beta-L-arabino-hex-4-ulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:60102 name: sulfurated eukaryotic molybdenum cofactor(2-) is_a: CHEBI:21437 ! Mo-molybdopterin cofactor [Term] id: CHEBI:60104 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl group is_a: CHEBI:21524 ! N-acetyl-D-glucosaminyl groups [Term] id: CHEBI:60105 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:21524 ! N-acetyl-D-glucosaminyl groups is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:60106 name: streptidine 6-phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:60107 name: N(5)-[(hydroxyamino)(imino)methyl]-L-ornithinium(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:60108 name: 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:60109 name: 3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:60110 name: 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:83195 ! glycerophosphoglycerophosphate anion [Term] id: CHEBI:60111 name: N(5)-[amino(hydroxyimino)methyl]-L-ornithine zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60113 name: (R)-nipecotamide is_a: CHEBI:60116 ! nipecotamide [Term] id: CHEBI:60114 name: alpha,alpha-trehalose-2-sulfate is_a: CHEBI:60117 ! trehalose sulfate [Term] id: CHEBI:60115 name: (S)-nipecotamide is_a: CHEBI:60116 ! nipecotamide [Term] id: CHEBI:60116 name: nipecotamide is_a: CHEBI:48592 ! piperidinecarboxamide [Term] id: CHEBI:60117 name: trehalose sulfate is_a: CHEBI:37909 ! oligosaccharide sulfate [Term] id: CHEBI:60118 name: (R)-nipecotamide(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:60119 name: sphingosine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60120 name: (R)-nipecotic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60129 name: (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36465 ! cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylate [Term] id: CHEBI:60131 name: (1S,6R)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36465 ! cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylate [Term] id: CHEBI:60151 name: oxidised LDL is_a: CHEBI:39026 ! low-density lipoprotein [Term] id: CHEBI:60152 name: beta-D-Galp-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:25002 ! lactosamines [Term] id: CHEBI:60158 name: (E)-4,8-dimethyl-1,3,7-nonatriene subset: chebi_ph7_3 is_a: CHEBI:33647 ! alkatriene [Term] id: CHEBI:60160 name: polyester polymer is_a: CHEBI:60027 ! polymer relationship: has_part CHEBI:26178 ! polyester macromolecule [Term] id: CHEBI:60164 name: ionic polymer is_a: CHEBI:60027 ! polymer relationship: has_part CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:60169 name: phosphatidylinositol trisphosphate is_a: CHEBI:28765 ! phosphatidylinositol phosphate [Term] id: CHEBI:60173 name: purine deoxyribonucleoside is_a: CHEBI:23636 ! deoxyribonucleoside is_a: CHEBI:26394 ! purine nucleoside [Term] id: CHEBI:60174 name: rhamnogalacturonan I is_a: CHEBI:26543 ! rhamnogalacturonan [Term] id: CHEBI:60175 name: 5-hydroxylysine is_a: CHEBI:86498 ! hydroxylysine [Term] id: CHEBI:60186 name: EC 3.6.3.8 (Ca(2+)-transporting ATPase) inhibitor is_a: CHEBI:76895 ! EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor [Term] id: CHEBI:60187 name: alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-D-Gal subset: chebi_ph7_3 is_a: CHEBI:146179 ! galactotriose [Term] id: CHEBI:60189 name: 4-(4-deoxy-alpha-D-gluc-4-enosyluronic acid)-D-galacturonate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:60190 name: homogalacturonan is_a: CHEBI:24174 ! galacturonan [Term] id: CHEBI:60191 name: rhamnogalacturonan II is_a: CHEBI:24174 ! galacturonan [Term] id: CHEBI:60192 name: triacyl lipopeptide is_a: CHEBI:46895 ! lipopeptide [Term] id: CHEBI:60193 name: queuosine is_a: CHEBI:50660 ! 7-deazaguanine ribonucleoside [Term] id: CHEBI:60194 name: peptide cation is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:60195 name: cyclic peptide cation is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:60196 name: O-phospho peptide cation is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:60197 name: bacteriochlorophyll c is_a: CHEBI:38201 ! bacteriochlorophyll [Term] id: CHEBI:60199 name: acyl monophosphate(1-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60202 name: D-glycero-beta-D-manno-heptose 7-phosphate is_a: CHEBI:28723 ! D-glycero-D-manno-heptose 7-phosphate [Term] id: CHEBI:60203 name: D-glycero-alpha-D-manno-heptose 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59955 ! D-glycero-D-manno-heptose 7-phosphate(2-) [Term] id: CHEBI:60204 name: D-glycero-beta-D-manno-heptose 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:59955 ! D-glycero-D-manno-heptose 7-phosphate(2-) [Term] id: CHEBI:60205 name: D-glycero-alpha-D-manno-heptose 1,7-bisphosphate is_a: CHEBI:4188 ! D-glycero-D-manno-heptose 1,7-bisphosphate [Term] id: CHEBI:60206 name: D-glycero-beta-D-manno-heptose 1,7-bisphosphate is_a: CHEBI:4188 ! D-glycero-D-manno-heptose 1,7-bisphosphate [Term] id: CHEBI:60207 name: D-glycero-alpha-D-manno-heptose 1,7-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59957 ! D-glycero-D-manno-heptose 1,7-bisphosphate(4-) [Term] id: CHEBI:60208 name: D-glycero-beta-D-manno-heptose 1,7-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59957 ! D-glycero-D-manno-heptose 1,7-bisphosphate(4-) [Term] id: CHEBI:60215 name: W-molybdopterin cofactor is_a: CHEBI:25372 ! molybdopterin cofactor is_a: CHEBI:35233 ! tungsten coordination entity [Term] id: CHEBI:60239 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59412 ! amino tetrasaccharide [Term] id: CHEBI:60240 name: divalent metal cation subset: chebi_ph7_3 is_a: CHEBI:25213 ! metal cation is_a: CHEBI:64641 ! divalent inorganic cation [Term] id: CHEBI:60242 name: monovalent inorganic cation subset: chebi_ph7_3 is_a: CHEBI:36915 ! inorganic cation [Term] id: CHEBI:60245 name: inositol phosphoceramide is_a: CHEBI:35786 ! phosphosphingolipid [Term] id: CHEBI:60247 name: silver ion is_a: CHEBI:33966 ! elemental silver is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:60248 name: nickel ion is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:60249 name: lead ion is_a: CHEBI:36914 ! inorganic ion is_a: CHEBI:37193 ! elemental lead [Term] id: CHEBI:60250 name: selenium ion is_a: CHEBI:36904 ! elemental selenium is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:60251 name: guanidinium ion subset: chebi_ph7_3 is_a: CHEBI:35286 ! iminium ion [Term] id: CHEBI:60252 name: lead cation is_a: CHEBI:25213 ! metal cation is_a: CHEBI:60249 ! lead ion [Term] id: CHEBI:60253 name: silver cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:60247 ! silver ion [Term] id: CHEBI:60254 name: (3R)-3-(tert-butylcarbamoyl)piperazin-1-ium subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:60255 name: puromycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:60256 name: (4R)-N-(2,3-dihydroxytetracosanoyl)-4-hydroxysphinganine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60257 name: N(omega)-methyl-L-arginine zwitterion is_a: CHEBI:24436 ! guanidines is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60258 name: EC 3.4.* (hydrolases acting on peptide bond) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:60260 name: 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion is_a: CHEBI:78198 ! 1-(alk-1-enyl)-2-acyl-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:60267 name: N(omega)-(ADP-D-ribosyl)-L-arginine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:60268 name: phosphonatoformate is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:60270 name: caesium ion is_a: CHEBI:36914 ! inorganic ion is_a: CHEBI:37128 ! caesium molecular entity [Term] id: CHEBI:60271 name: tellurium ion is_a: CHEBI:36660 ! elemental tellurium is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:60272 name: aluminium ion is_a: CHEBI:33628 ! elemental aluminium is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:60273 name: 1,2-dilauroyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:60274 name: 1,2-dicaproyl-sn-glycero-3-phosphocholine is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:60302 name: L-thyroxine(1-) is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:60308 name: 3,3',5-triiodo-L-thyroninate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63477 ! iodothyroninate [Term] id: CHEBI:60311 name: thyroid hormone is_a: CHEBI:24621 ! hormone [Term] id: CHEBI:60312 name: 2-amino-2-deoxy-D-galactopyranose is_a: CHEBI:28328 ! D-galactosamine is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:27026 ! toxin [Term] id: CHEBI:60319 name: 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:6032 name: isonicotinic acid is_a: CHEBI:26420 ! pyridinemonocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:60327 name: ganglioside GM2 (18:0) is_a: CHEBI:21509 ! N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine is_a: CHEBI:36541 ! sialotriaosylceramide relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:60331 name: 2-O-(6-phospho-alpha-D-mannosyl)-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:60332 name: alpha-D-mannose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:60334 name: peptide anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:60344 name: ferroheme b(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60345 name: organic phosphoramidate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:60356 name: tetraoleyl cardiolipin is_a: CHEBI:28494 ! cardiolipin relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:60362 name: (KDO)3-lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:60364 name: (KDO)-lipid IVA(5-) subset: chebi_ph7_3 is_a: CHEBI:176428 ! a Kdo-lipid IVA(5-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:60365 name: (KDO)2-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:176429 ! a (Kdo)2-lipid IVA(6-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:60367 name: (KDO)3-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:193025 ! an alpha-Kdo-(2->4)-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(7-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:60369 name: trans,poly-cis-decaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60373 name: lipid IVA oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60374 name: 2-cis,6-cis-farnesyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60377 name: cytidine 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138238 ! pyrimidine ribonucleoside 5'-monophosphate(2-) is_a: CHEBI:26443 ! pyrimidine ribonucleoside monophosphate is_a: CHEBI:26446 ! pyrimidine ribonucleotide is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60384 name: N-(2,3-dihydroxyhexacosanoyl)-(4R)-hydroxysphinganine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60385 name: ditrans,polycis-tridecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60386 name: ditrans,polycis-dodecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60387 name: ditrans,polycis-tetradecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60388 name: tri-trans,poly-cis-undecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60389 name: alpha-L-galactose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58908 ! L-galactose 1-phosphate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:6039 name: isopimaric acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:60390 name: D-alanyl-D-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:60392 name: ditrans,polycis-undecaprenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60402 name: Ins-1-P-Cer(d18:0/24:0) is_a: CHEBI:60245 ! inositol phosphoceramide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60405 name: Ins-1-P-Cer(d18:0/26:0) is_a: CHEBI:60245 ! inositol phosphoceramide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60409 name: Ins-1-P-Cer(d18:0/2-OH-26:0) is_a: CHEBI:60245 ! inositol phosphoceramide relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:6041 name: (+)-isopiperitenone subset: chebi_ph7_3 is_a: CHEBI:50110 ! isopiperitenone [Term] id: CHEBI:60416 name: Man-beta1-6-Ins-1-P-Cer(d18:0/24:0) is_a: CHEBI:139446 ! Man-1-6-Ins-1-P-Cer(d18:0) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60427 name: dioleoyl phosphatidic acid is_a: CHEBI:134027 ! 1,2-bis(octadec-9-enoyl)phosphatidic acid [Term] id: CHEBI:60430 name: 2-monolysocardiolipin is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:60431 name: 2,2'-dilysocardiolipin is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:60448 name: mannose-1D-myo-inositol 1-phosphate is_a: CHEBI:84140 ! myo-inositol monophosphate derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60449 name: mannose-(1D-myo-inositol 1-phosphate)2 is_a: CHEBI:84140 ! myo-inositol monophosphate derivative relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60454 name: Fe-coproporphyrin III is_a: CHEBI:25216 ! metalloporphyrin relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:60459 name: trans,poly-cis-decaprenyl diphosphate is_a: CHEBI:53043 ! decaprenyl diphosphate [Term] id: CHEBI:60460 name: ditrans,polycis-tridecaprenyl diphosphate is_a: CHEBI:53040 ! tridecaprenyl diphosphate [Term] id: CHEBI:60461 name: ditrans,polycis-dodecaprenyl diphosphate is_a: CHEBI:53041 ! dodecaprenyl diphosphate [Term] id: CHEBI:60462 name: ditrans,polycis-tetradecaprenyl diphosphate is_a: CHEBI:53039 ! tetradecaprenyl diphosphate [Term] id: CHEBI:60463 name: 4-amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:60464 name: tri-trans,poly-cis-undecaprenyl diphosphate is_a: CHEBI:53042 ! undecaprenyl diphosphate [Term] id: CHEBI:60465 name: alpha-L-galactose 1-phosphate is_a: CHEBI:53025 ! L-galactose 1-phosphate [Term] id: CHEBI:60466 name: peptide zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:60467 name: D-alanyl-D-serine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:60468 name: ditrans,polycis-undecaprenyl phosphate is_a: CHEBI:27193 ! undecaprenyl phosphate [Term] id: CHEBI:60471 name: dUDP(3-) subset: chebi_ph7_3 is_a: CHEBI:73316 ! 2'-deoxyribonucleoside 5'-diphosphate(3-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60472 name: 4-amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,polycis-undecaprenyl phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:60473 name: 5,10-methylenetetrahydrofolate polyglutamate macromolecule subset: chebi_ph7_3 is_a: CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:60479 name: lysophosphatidylcholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60481 name: N',N'',N'''-triacetylfusarinine C subset: chebi_ph7_3 is_a: CHEBI:33892 ! iron coordination entity is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:60486 name: trehalose monomycolate is_a: CHEBI:27083 ! trehalose mycolate [Term] id: CHEBI:60487 name: adenosylcobinamide guanosyl diphosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60488 name: cob(I)alamin(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:60489 name: magnesium 13(1)-hydroxyprotoporphyrin 13-monomethyl ester(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60490 name: magnesium 13(1)-oxoprotoporphyrin 13-monomethyl ester(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60491 name: magnesium protoporphyrin 13-monomethyl ester(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60492 name: magnesium protoporphyrin(2-) subset: chebi_ph7_3 is_a: CHEBI:25111 ! magnesium porphyrin [Term] id: CHEBI:60493 name: adenosylcobalamin 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140785 ! R-cob(III)alamin is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60494 name: 5-hydroxybenzimidazolylcob(I)amide(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:60520 name: 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:68488 ! alkyl,acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:78197 ! 1-alkyl-2-acyl-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:60521 name: indole alkaloid cation is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:60522 name: phosphatidylglycerol phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:83195 ! glycerophosphoglycerophosphate anion [Term] id: CHEBI:60523 name: phosphatidylglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60524 name: 3-O-L-alanyl-1-O-phosphatidylglycerol zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:60529 name: ergoline alkaloid is_a: CHEBI:22315 ! alkaloid [Term] id: CHEBI:60530 name: ferroheme o(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60531 name: flavin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:60540 name: coenzyme F430(5-) subset: chebi_ph7_3 is_a: CHEBI:35755 ! pentacarboxylic acid anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:60549 name: ferroheme d1(4-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:60562 name: ferroheme c is_a: CHEBI:38573 ! ferroheme relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:60568 name: 1,2-dioleoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:90437 ! phosphatidylserine(18:1/18:1) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:60575 name: phenoxy herbicide is_a: CHEBI:24527 ! herbicide [Term] id: CHEBI:60584 name: bicozamycin subset: chebi_ph7_3 is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38295 ! azabicycloalkane relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:55323 ! antidiarrhoeal drug [Term] id: CHEBI:60598 name: opioid agent is_a: CHEBI:35942 ! neurotransmitter agent [Term] id: CHEBI:60599 name: mu-opioid agent is_a: CHEBI:60598 ! opioid agent [Term] id: CHEBI:60601 name: delta-opioid agent is_a: CHEBI:60598 ! opioid agent [Term] id: CHEBI:60606 name: opioid receptor agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:60598 ! opioid agent [Term] id: CHEBI:60615 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:60625 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:60627 name: N(4)-\{alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:60628 name: N(4)-\{alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:60637 name: N(4)-\{alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue [Term] id: CHEBI:60643 name: NMDA receptor antagonist is_a: CHEBI:60798 ! excitatory amino acid antagonist [Term] id: CHEBI:60645 name: 2-hydroxy-3-methylbutyric acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60651 name: N(4)-\{beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc}-Asn residue subset: chebi_ph7_3 is_a: CHEBI:59108 ! N(4)-glycosylated L-asparagine residue relationship: has_part CHEBI:63488 ! beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc-yl group [Term] id: CHEBI:60653 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphocholine(1+) is_a: CHEBI:16110 ! 1,2-diacyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:60655 name: 6-methoxy-2-octaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:60656 name: 5-methoxy-2-methyl-3-octaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:606564 name: prostaglandin E2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:36063 ! oxytocic relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:606565 name: N-benzoylglycinate subset: chebi_ph7_3 is_a: CHEBI:132966 ! hippurates relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60657 name: 1,2-di-O-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:60687 name: cembrane diterpenoid is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:60689 name: cembrane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:60690 name: nitrogen-containing fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:60691 name: aza fatty acid is_a: CHEBI:60690 ! nitrogen-containing fatty acid [Term] id: CHEBI:60721 name: all-trans-decaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:157763 ! polyprenol phosphate anion is_a: CHEBI:167056 ! polyprenol diphosphate(3-) is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:60724 name: dipalmitoyl phosphatidylglycerol is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:60732 name: guanosine 3'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:66949 ! nucleoside 3'-phosphate(2-) [Term] id: CHEBI:6076 name: itraconazole subset: chebi_ph7_3 is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35727 ! triazoles is_a: CHEBI:39430 ! dioxolane is_a: CHEBI:46848 ! N-arylpiperazine is_a: CHEBI:59779 ! cyclic ketal is_a: CHEBI:87071 ! conazole antifungal drug is_a: CHEBI:87101 ! triazole antifungal drug relationship: has_role CHEBI:140921 ! Hedgehog signaling pathway inhibitor relationship: has_role CHEBI:50183 ! P450 inhibitor relationship: has_role CHEBI:77748 ! EC 3.6.3.44 (xenobiotic-transporting ATPase) inhibitor [Term] id: CHEBI:60761 name: floxuridine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:60783 ! nucleoside analogue relationship: has_role CHEBI:132992 ! radiosensitizing agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:36044 ! antiviral drug [Term] id: CHEBI:60777 name: 3-deoxyglucosone subset: chebi_ph7_3 is_a: CHEBI:23623 ! deoxyglucose is_a: CHEBI:24965 ! deoxyketohexose [Term] id: CHEBI:60783 name: nucleoside analogue is_a: CHEBI:21731 ! N-glycosyl compound [Term] id: CHEBI:60784 name: 3'-UMP(2-) subset: chebi_ph7_3 is_a: CHEBI:66949 ! nucleoside 3'-phosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60798 name: excitatory amino acid antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:60801 name: guanyl deoxyribonucleotide residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:60807 name: anaesthesia adjuvant is_a: CHEBI:60809 ! adjuvant [Term] id: CHEBI:60809 name: adjuvant is_a: CHEBI:52217 ! pharmaceutical [Term] id: CHEBI:60815 name: lysobisphosphatidic acid is_a: CHEBI:32957 ! lysophosphatidic acids [Term] id: CHEBI:60816 name: immunogen is_a: CHEBI:59132 ! antigen [Term] id: CHEBI:60817 name: 1,1'-lysobisphosphatidic acid is_a: CHEBI:60815 ! lysobisphosphatidic acid [Term] id: CHEBI:60818 name: 2,2'-lysobisphosphatidic acid is_a: CHEBI:60815 ! lysobisphosphatidic acid [Term] id: CHEBI:60819 name: diphenyl phthalate subset: chebi_ph7_3 is_a: CHEBI:35484 ! phthalate ester is_a: CHEBI:51307 ! diester [Term] id: CHEBI:60820 name: 1-C-(indol-3-yl)glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60821 name: streptothricin F is_a: CHEBI:26789 ! streptothricin relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:60822 name: streptothricin F(3+) subset: chebi_ph7_3 is_a: CHEBI:58001 ! primary aliphatic ammonium ion is_a: CHEBI:60251 ! guanidinium ion relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:60823 name: streptothricin F acid is_a: CHEBI:60826 ! streptothricin acid [Term] id: CHEBI:60826 name: streptothricin acid is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:24436 ! guanidines is_a: CHEBI:35931 ! delta-amino acid is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:60828 name: streptothricin D is_a: CHEBI:26789 ! streptothricin relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:60829 name: streptothricin D(5+) subset: chebi_ph7_3 is_a: CHEBI:58001 ! primary aliphatic ammonium ion is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:60830 name: streptothricin D acid is_a: CHEBI:60826 ! streptothricin acid [Term] id: CHEBI:60831 name: epothilone is_a: CHEBI:25106 ! macrolide is_a: CHEBI:38418 ! 1,3-thiazoles is_a: CHEBI:55380 ! beta-hydroxy ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:60832 name: tubulin modulator is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:60833 name: naptalam is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:35735 ! dicarboxylic acid monoamide is_a: CHEBI:88360 ! N-(1-naphthyl)carboxamide relationship: has_role CHEBI:24527 ! herbicide [Term] id: CHEBI:60835 name: leucoanthocyanidin subset: chebi_ph7_3 is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:60836 name: phytochelatin is_a: CHEBI:16670 ! peptide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:38161 ! chelator [Term] id: CHEBI:60837 name: 2',3'-cyclic GMP(1-) subset: chebi_ph7_3 is_a: CHEBI:66954 ! 2',3'-cyclic nucleotide(1-) [Term] id: CHEBI:60838 name: streptothricin F acid (pH 7.3) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58001 ! primary aliphatic ammonium ion is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:60839 name: streptothricin D acid (pH 7.3) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58001 ! primary aliphatic ammonium ion is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:60841 name: 2,3-dihydro-3-hydroxyanthranilic acid is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:60843 name: (2R,3R)-2,3-dihydro-3-hydroxyanthranilic acid is_a: CHEBI:60841 ! 2,3-dihydro-3-hydroxyanthranilic acid [Term] id: CHEBI:60844 name: (2S,3S)-2,3-dihydro-3-hydroxyanthranilic acid is_a: CHEBI:60841 ! 2,3-dihydro-3-hydroxyanthranilic acid [Term] id: CHEBI:60847 name: 2,3-dihydro-3-hydroxyanthranilic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60848 name: (2R,3R)-2,3-dihydro-3-hydroxyanthranilic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:60847 ! 2,3-dihydro-3-hydroxyanthranilic acid zwitterion [Term] id: CHEBI:60849 name: (2S,3S)-2,3-dihydro-3-hydroxyanthranilic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:60847 ! 2,3-dihydro-3-hydroxyanthranilic acid zwitterion [Term] id: CHEBI:60854 name: 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:60857 name: (1R,6S)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid is_a: CHEBI:60854 ! 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid [Term] id: CHEBI:60858 name: (1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid is_a: CHEBI:60854 ! 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid [Term] id: CHEBI:60860 name: 6-ammonio-5-oxocyclohex-2-ene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60862 name: (1R,6S)-6-ammonio-5-oxocyclohex-2-ene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:60860 ! 6-ammonio-5-oxocyclohex-2-ene-1-carboxylate [Term] id: CHEBI:60863 name: (1S,6R)-6-ammonio-5-oxocyclohex-2-ene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:60860 ! 6-ammonio-5-oxocyclohex-2-ene-1-carboxylate [Term] id: CHEBI:60870 name: aza fatty acid anion is_a: CHEBI:28868 ! fatty acid anion is_a: CHEBI:61008 ! nitrogen-containing fatty acid anion [Term] id: CHEBI:60873 name: 2',3'-cyclic UMP(1-) subset: chebi_ph7_3 is_a: CHEBI:66954 ! 2',3'-cyclic nucleotide(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60874 name: phenylacetylglycine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60875 name: 3'-CMP(2-) subset: chebi_ph7_3 is_a: CHEBI:66949 ! nucleoside 3'-phosphate(2-) [Term] id: CHEBI:60877 name: 2',3'-cyclic CMP(1-) subset: chebi_ph7_3 is_a: CHEBI:66954 ! 2',3'-cyclic nucleotide(1-) [Term] id: CHEBI:60878 name: 3-geranyl-4-hydroxybenzoate(1-) subset: chebi_ph7_3 is_a: CHEBI:24675 ! hydroxybenzoate [Term] id: CHEBI:60879 name: 2',3'-cyclic AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:66954 ! 2',3'-cyclic nucleotide(1-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:60880 name: 3'-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:66949 ! nucleoside 3'-phosphate(2-) relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:60885 name: (2E,4E)-6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:36537 ! 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoate [Term] id: CHEBI:60886 name: (2E)-2-hydroxypenta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:37319 ! 2-hydroxypenta-2,4-dienoate is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:60887 name: 3-hydroxy-D-aspartic acid is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:83979 ! D-aspartic acid derivative is_a: CHEBI:83981 ! 3-hydroxyaspartic acid relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:60892 name: polyamino carboxylic acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:60893 name: (3S)-3-hydroxy-D-aspartic acid is_a: CHEBI:60887 ! 3-hydroxy-D-aspartic acid [Term] id: CHEBI:60894 name: (3S)-3-hydroxy-D-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:60895 ! D-alpha-amino acid anion [Term] id: CHEBI:60895 name: D-alpha-amino acid anion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:60897 name: (3R)-3-hydroxy-D-aspartic acid is_a: CHEBI:60887 ! 3-hydroxy-D-aspartic acid [Term] id: CHEBI:60898 name: (3R)-3-hydroxy-D-aspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:60895 ! D-alpha-amino acid anion [Term] id: CHEBI:60899 name: ubiquinol-0 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol [Term] id: CHEBI:60903 name: N-(4-aminobenzoyl)-L-glutamate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:60904 name: 4-hydroxy-L-threonine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:60907 name: (S)-ethylmalonyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:60908 name: (2R)-2-hydroxy-2-methylbutanenitrile subset: chebi_ph7_3 is_a: CHEBI:60954 ! 2-hydroxy-2-methylbutanenitrile [Term] id: CHEBI:60909 name: (S)-ethylmalonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:60911 name: racemate is_a: CHEBI:60004 ! mixture [Term] id: CHEBI:60913 name: ganglioside GT1b is_a: CHEBI:28058 ! alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer [Term] id: CHEBI:60924 name: keratan sulfate is_a: CHEBI:35722 ! sulfated glycosaminoglycan is_a: CHEBI:37395 ! mucopolysaccharide [Term] id: CHEBI:60926 name: amino monosaccharide is_a: CHEBI:28963 ! amino sugar [Term] id: CHEBI:60929 name: arbutin 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:60932 name: (R)-carnitinyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:60933 name: (E)-4-(trimethylammonio)but-2-enoyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:60935 name: sinapate ester subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:60938 name: glucuronoxylan is_a: CHEBI:37166 ! xylan [Term] id: CHEBI:60940 name: D-mannosyl-D-glyceric acid is_a: CHEBI:25169 ! mannoside is_a: CHEBI:33720 ! carbohydrate acid [Term] id: CHEBI:60941 name: prenylcysteine is_a: CHEBI:23509 ! cysteine derivative [Term] id: CHEBI:60943 name: 5-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:60948 name: alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-D-Glc subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:60951 name: flavonoid phytoalexin is_a: CHEBI:47916 ! flavonoid relationship: has_role CHEBI:26115 ! phytoalexin [Term] id: CHEBI:60952 name: diterpene phytoalexin is_a: CHEBI:180906 ! terpenoid phytoalexin is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:60954 name: 2-hydroxy-2-methylbutanenitrile subset: chebi_ph7_3 is_a: CHEBI:23437 ! cyanohydrin [Term] id: CHEBI:60955 name: 9(S)-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) is_a: CHEBI:146293 ! 9-HPODE(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:60956 name: colneleic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:61411 ! divinyl ether fatty acid [Term] id: CHEBI:60957 name: colneleate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:61413 ! oxa fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:60959 name: colnelenic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:61411 ! divinyl ether fatty acid [Term] id: CHEBI:60960 name: colnelenate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:61413 ! oxa fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:60961 name: (9S,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid is_a: CHEBI:63238 ! (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid [Term] id: CHEBI:60962 name: (9S,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:63239 ! (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate [Term] id: CHEBI:60963 name: colanic acid is_a: CHEBI:65212 ! polysaccharide derivative relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:60968 name: presilphiperfolan-8beta-ol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51959 ! organic tricyclic compound [Term] id: CHEBI:60971 name: aminophospholipid is_a: CHEBI:16247 ! phospholipid is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:60973 name: suberin is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:26178 ! polyester macromolecule [Term] id: CHEBI:60974 name: cyanoamino acid is_a: CHEBI:80291 ! aliphatic nitrile is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:60977 name: phenylalkylamine is_a: CHEBI:22644 ! arylalkylamine [Term] id: CHEBI:60978 name: ketogluconate is_a: CHEBI:33804 ! gluconates [Term] id: CHEBI:60979 name: alpha-glucoside is_a: CHEBI:24278 ! glucoside [Term] id: CHEBI:60980 name: beta-glucoside is_a: CHEBI:24278 ! glucoside [Term] id: CHEBI:60981 name: UDP-rhamnose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:60982 name: methyl galactoside is_a: CHEBI:24163 ! galactoside is_a: CHEBI:25302 ! methyl glycoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:609827 name: L-canavanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:22917 ! phytogenic insecticide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6099 name: kaempferide is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:52267 ! 7-hydroxyflavonol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35674 ! antihypertensive agent [Term] id: CHEBI:60991 name: 2-hydroxyethylphosphonic acid(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:60996 name: (2R)-3-sulfopropanediol is_a: CHEBI:77267 ! 3-sulfopropanediol [Term] id: CHEBI:60997 name: (2R)-3-sulfopropanediol(1-) subset: chebi_ph7_3 is_a: CHEBI:77138 ! 3-sulfopropanediol(1-) [Term] id: CHEBI:61001 name: 2-O-(6-phosphono-alpha-D-mannosyl)-D-glyceric acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:61006 name: mannosyl diphosphorylinositol ceramide is_a: CHEBI:59466 ! phosphatidylinositol mannoside is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:61007 name: amino fatty acid anion is_a: CHEBI:37022 ! amino-acid anion is_a: CHEBI:61008 ! nitrogen-containing fatty acid anion [Term] id: CHEBI:61008 name: nitrogen-containing fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:61011 name: all-trans-decaprenyl diphosphate is_a: CHEBI:53043 ! decaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate [Term] id: CHEBI:61015 name: nephrotoxin is_a: CHEBI:50909 ! nephrotoxic agent is_a: CHEBI:64909 ! poison [Term] id: CHEBI:61016 name: angiotensin receptor antagonist is_a: CHEBI:49020 ! hormone antagonist [Term] id: CHEBI:61027 name: (2E,4E)-6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid is_a: CHEBI:197289 ! 6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid [Term] id: CHEBI:61032 name: 5,6,7,8-tetrahydropterin-6-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:61036 name: 7-carboxylato-7-deazaguanine subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:6104 name: kanamycin is_a: CHEBI:24951 ! kanamycins relationship: has_part CHEBI:17630 ! kanamycin A relationship: has_part CHEBI:28098 ! kanamycin B relationship: has_part CHEBI:28185 ! kanamycin C relationship: has_part CHEBI:72797 ! kanamycin X relationship: has_part CHEBI:73079 ! kanamycin D [Term] id: CHEBI:61042 name: 1-hexadecanoyl-2-(9-oxononanoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:137684 ! Papio hamadryas metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61048 name: ganglioside GM1 is_a: CHEBI:18216 ! alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_part CHEBI:142514 ! ->8)-alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-yl group [Term] id: CHEBI:61049 name: tacrolimus (anhydrous) subset: chebi_ph7_3 is_a: CHEBI:145565 ! macrolide lactam relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:61050 name: alkyl hydroperoxide is_a: CHEBI:35924 ! peroxol [Term] id: CHEBI:61051 name: lipid hydroperoxide subset: chebi_ph7_3 is_a: CHEBI:18059 ! lipid is_a: CHEBI:35924 ! peroxol [Term] id: CHEBI:61073 name: oxygen radical is_a: CHEBI:26523 ! reactive oxygen species is_a: CHEBI:36871 ! inorganic radical [Term] id: CHEBI:61078 name: purine nucleoside bisphosphate is_a: CHEBI:26401 ! purines is_a: CHEBI:37123 ! nucleoside bisphosphate [Term] id: CHEBI:61079 name: ribonucleoside bisphosphate is_a: CHEBI:37123 ! nucleoside bisphosphate [Term] id: CHEBI:61081 name: bis(5'-nucleosidyl) oliogophosphate is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:61082 name: lipid-linked peptidoglycan is_a: CHEBI:8005 ! peptidoglycan [Term] id: CHEBI:61085 name: 3-sulfino-L-alanine(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61109 name: pyrimidine nucleotide-sugar is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:61111 name: aminophosphonate is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:37592 ! organic phosphonate [Term] id: CHEBI:61112 name: methyl thiocyanate subset: chebi_ph7_3 is_a: CHEBI:26955 ! thiocyanates [Term] id: CHEBI:61114 name: N-(4-aminobenzoyl)-L-glutamic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:61115 name: EC 3.5.1.98 (histone deacetylase) inhibitor is_a: CHEBI:76807 ! EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor [Term] id: CHEBI:61119 name: dTDP-rhamnose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:61120 name: nucleobase-containing molecular entity is_a: CHEBI:33833 ! heteroarene is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:61121 name: oxylipin is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:61122 name: 3-geranyl-4-hydroxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid [Term] id: CHEBI:61123 name: (E)-4-(trimethylammonio)but-2-enoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:61125 name: 7-carboxy-7-deazaguanine is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38670 ! pyrrolopyrimidine [Term] id: CHEBI:61126 name: 5,6,7,8-tetrahydropterin-6-carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:30436 ! tetrahydropterin [Term] id: CHEBI:61129 name: N-hydroxy-L-isoleucine is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid is_a: CHEBI:61130 ! hydroxy-L-isoleucine [Term] id: CHEBI:61130 name: hydroxy-L-isoleucine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:61131 name: N-hydroxy-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:61132 name: N,N-dihydroxy-L-isoleucine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative [Term] id: CHEBI:61133 name: N,N-dihydroxy-L-isoleucinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:61134 name: 2-methylbutanal oxime subset: chebi_ph7_3 is_a: CHEBI:82744 ! aliphatic aldoxime [Term] id: CHEBI:61135 name: (E)-2-methylbutanal oxime subset: chebi_ph7_3 is_a: CHEBI:61134 ! 2-methylbutanal oxime [Term] id: CHEBI:61136 name: (Z)-2-methylbutanal oxime subset: chebi_ph7_3 is_a: CHEBI:61134 ! 2-methylbutanal oxime [Term] id: CHEBI:61138 name: N-hydroxy-L-valine is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:50760 ! N-hydroxy-alpha-amino-acid is_a: CHEBI:61139 ! hydroxy-L-valine [Term] id: CHEBI:61139 name: hydroxy-L-valine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:84129 ! L-valine derivative [Term] id: CHEBI:61140 name: N-hydroxy-L-valinate subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59258 ! N-hydroxy-alpha-amino-acid anion [Term] id: CHEBI:61141 name: N,N-dihydroxy-L-valine is_a: CHEBI:50766 ! N,N-dihydroxy-alpha-amino acid is_a: CHEBI:84129 ! L-valine derivative [Term] id: CHEBI:61142 name: N,N-dihydroxy-L-valinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59699 ! N,N-dihydroxy-alpha-amino-acid anion [Term] id: CHEBI:61143 name: (E)-2-methylpropanal oxime subset: chebi_ph7_3 is_a: CHEBI:17502 ! 2-methylpropanal oxime [Term] id: CHEBI:61144 name: (Z)-2-methylpropanal oxime subset: chebi_ph7_3 is_a: CHEBI:17502 ! 2-methylpropanal oxime [Term] id: CHEBI:61146 name: 4-nitrophenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61147 name: ferroheme d1 is_a: CHEBI:35742 ! tetracarboxylic acid is_a: CHEBI:38573 ! ferroheme is_a: CHEBI:46640 ! diketone is_a: CHEBI:62804 ! metallochlorin [Term] id: CHEBI:61148 name: drimenol subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:61149 name: 2,3-dihydro-3-oxoanthranilic acid is_a: CHEBI:25754 ! oxo carboxylic acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:61150 name: 2,3-dihydro-3-oxoanthranilate is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:61151 name: poly-ADP-D-ribose is_a: CHEBI:33694 ! biomacromolecule is_a: CHEBI:65212 ! polysaccharide derivative relationship: has_part CHEBI:16960 ! ADP-D-ribose [Term] id: CHEBI:61158 name: 3''-hydroxy-geranylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:61159 name: conjugated linoleic acid is_a: CHEBI:25627 ! octadecadienoic acid [Term] id: CHEBI:61160 name: conjugated linolenic acid is_a: CHEBI:25633 ! octadecatrienoic acid [Term] id: CHEBI:61162 name: poly(3-hydroxycarboxylic acid) macromolecule is_a: CHEBI:26178 ! polyester macromolecule is_a: CHEBI:37997 ! homopolymer macromolecule [Term] id: CHEBI:61163 name: D-alanyl-(R)-lactic acid is_a: CHEBI:23643 ! depsipeptide is_a: CHEBI:61165 ! D-alanyl ester [Term] id: CHEBI:61165 name: D-alanyl ester is_a: CHEBI:46874 ! alpha-amino acid ester is_a: CHEBI:83944 ! D-alanine derivative [Term] id: CHEBI:61166 name: D-alanyl-(R)-lactic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:61185 name: L-pipecolic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:61186 name: 7,8-dihydromonapterin 3-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61190 name: beta-D-GalpNAc-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22480 ! amino disaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:61191 name: 7,8-dihydromonapterin 3-triphosphate is_a: CHEBI:25500 ! neopterins is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:61194 name: 2'-deoxyinosine 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:142198 ! purine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61197 name: phlobaphene is_a: CHEBI:60004 ! mixture relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:61200 name: 3-decenoic acid is_a: CHEBI:36003 ! decenoic acid [Term] id: CHEBI:61201 name: beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61204 name: docosapentaenoic acid is_a: CHEBI:132543 ! fatty acid 22:5 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:61205 name: docosatetraenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:6121 name: ketamine is_a: CHEBI:23482 ! cyclohexanones is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:38877 ! intravenous anaesthetic relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:61211 name: beta-D-Man-(1->4)-beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61216 name: ditrans,polycis-undecaprenol subset: chebi_ph7_3 is_a: CHEBI:27191 ! undecaprenols [Term] id: CHEBI:61227 name: beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61230 name: beta-D-Man-(1->4)-beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61231 name: L-seryl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61232 name: N-acylphosphatidylethanolamine is_a: CHEBI:16038 ! phosphatidylethanolamine is_a: CHEBI:29347 ! monocarboxylic acid amide [Term] id: CHEBI:61233 name: spermidine hydroxycinnamic acid conjugate is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:61240 name: beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61243 name: beta-D-Galp-(1->3)-beta-D-GalpNAc subset: chebi_ph7_3 is_a: CHEBI:146500 ! D-Galp-(1->3)-D-GalpNAc is_a: CHEBI:546807 ! beta-D-Galp-(1->3)-D-GalpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:61246 name: beta-D-Galp-(1->3)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:27707 ! beta-D-Galp-(1->3)-D-GlcpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:61247 name: beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61249 name: hesperetin(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:61251 name: alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61252 name: alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61253 name: alpha-D-glucosyl ditrans,polycis-undecaprenyl diphosphate is_a: CHEBI:17223 ! polyprenyl glucosyl phosphate [Term] id: CHEBI:61254 name: alpha-D-glucosyl ditrans,polycis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61264 name: pectic arabinan is_a: CHEBI:59595 ! arabinofuranosyl group [Term] id: CHEBI:61265 name: (beta-D-glucopyranosyloxymethyl)deoxyuridine 5'-monophosphate residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:61266 name: hemicellulose is_a: CHEBI:18154 ! polysaccharide [Term] id: CHEBI:61267 name: 5-nitroanthranilate subset: chebi_ph7_3 is_a: CHEBI:16567 ! anthranilate [Term] id: CHEBI:61268 name: 5-nitrosalicylate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate is_a: CHEBI:30762 ! salicylate [Term] id: CHEBI:61269 name: scopolamine(1+) is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:61278 name: scutellarin is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:52726 ! proteasome inhibitor [Term] id: CHEBI:61280 name: 5-nitroanthranilic acid is_a: CHEBI:22495 ! aminobenzoic acid [Term] id: CHEBI:61281 name: 5-nitrosalicylic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:88306 ! 4-nitrophenols [Term] id: CHEBI:61282 name: wogonin 7-O-beta-D-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38687 ! monohydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:61283 name: baicalin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61284 name: scutellarin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61285 name: wogonin 7-O-beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61286 name: dolichol-linked oligosaccharide is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:61287 name: (S)-2-O-sulfonatolactate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:61289 name: (S)-3-sulfonatolactate(2-) subset: chebi_ph7_3 is_a: CHEBI:58683 ! 3-sulfonatolactate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61291 name: (R)-4-phosphopantoic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:61292 name: guanyl nucleotide is_a: CHEBI:26395 ! purine nucleotide [Term] id: CHEBI:61293 name: adenyl nucleotide is_a: CHEBI:26395 ! purine nucleotide [Term] id: CHEBI:61294 name: (R)-4-phosphonatopantoate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61295 name: guanyl ribonucleotide is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:61292 ! guanyl nucleotide [Term] id: CHEBI:61296 name: adenyl ribonucleotide is_a: CHEBI:26400 ! purine ribonucleotide is_a: CHEBI:61293 ! adenyl nucleotide [Term] id: CHEBI:61297 name: adenyl deoxyribonucleotide is_a: CHEBI:26390 ! purine 2'-deoxyribonucleotide is_a: CHEBI:61293 ! adenyl nucleotide [Term] id: CHEBI:61298 name: D-glucose- and/or D-galactose-substituted mannan is_a: CHEBI:16966 ! heteroglycan [Term] id: CHEBI:61301 name: germacra-1(10),4,11(13)-trien-12-oate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:61302 name: cerebronic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:61304 name: phosphoglycerate is_a: CHEBI:24347 ! glycerates is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61305 name: germacra-1(10),4,11(13)-trien-12-oic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:68588 ! germacrane sesquiterpenoid [Term] id: CHEBI:61307 name: solavetivol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:61310 name: chromium ion is_a: CHEBI:23237 ! chromium molecular entity is_a: CHEBI:36914 ! inorganic ion [Term] id: CHEBI:61312 name: 5-hydroxypseudobaptigenin is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:55465 ! 7-hydroxyisoflavones [Term] id: CHEBI:61313 name: C21-steroid subset: chebi_ph7_3 is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:61314 name: XTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) [Term] id: CHEBI:61316 name: (3Z)-hex-3-en-1-yl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:61317 name: cyanidin 3-O-(2-O-beta-D-glucuronosyl)-beta-D-glucoside betaine is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:61318 name: cyanidin 3-O-beta-D-glucoside betaine is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:61323 name: pratensein(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:61330 name: icosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:61336 name: C4-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:61338 name: bacillithiol is_a: CHEBI:24400 ! glycoside is_a: CHEBI:29256 ! thiol is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:61339 name: 5-hydroxypseudobaptigenin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:61344 name: (S)-beta-macrocarpene subset: chebi_ph7_3 is_a: CHEBI:33663 ! cyclic hydrocarbon is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:61345 name: chrysobactin is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33566 ! catechols is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:26672 ! siderophore relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:61346 name: achromobactin subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion relationship: has_role CHEBI:26672 ! siderophore [Term] id: CHEBI:61355 name: 3-hydroxy carboxylic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid [Term] id: CHEBI:61360 name: globoside is_a: CHEBI:24402 ! glycosphingolipid [Term] id: CHEBI:61362 name: cyclitol ether is_a: CHEBI:25698 ! ether [Term] id: CHEBI:61366 name: 2-tetradecenoic acid is_a: CHEBI:36004 ! tetradecenoic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:61375 name: ferric-vibriobactin is_a: CHEBI:84734 ! Fe(III)-complexed siderophore [Term] id: CHEBI:61377 name: TDP is_a: CHEBI:37039 ! pyrimidine ribonucleoside 5'-diphosphate [Term] id: CHEBI:61378 name: 2'-(5-triphosphoribosyl)-3'-dephospho-CoA(6-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61380 name: acetylenic fatty acid anion is_a: CHEBI:2580 ! unsaturated fatty acid anion [Term] id: CHEBI:61381 name: D-mannitol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61382 name: dITP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61383 name: dTDP-4-acetamido-4,6-dideoxy-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61384 name: sulfolipid is_a: CHEBI:18059 ! lipid is_a: CHEBI:25704 ! organic sulfate [Term] id: CHEBI:61385 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:58510 ! UDP-3-O-(3-hydroxytetradecanoyl)-D-glucosamine(1-) [Term] id: CHEBI:61386 name: UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alaninate(4-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:61387 name: undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine(4-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:61388 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine(4-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:61392 name: fructoselysine 6-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:61393 name: fructosyllysine(1+) subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:61395 name: L-alanyl-D-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:61396 name: L-alanyl-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:61401 name: L-alanyl-gamma-D-glutamyl-meso-diaminopimelate(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:61402 name: ITP(4-) subset: chebi_ph7_3 is_a: CHEBI:61557 ! nucleoside 5'-triphoshate(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:61403 name: psicosyllysine(1+) subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:61404 name: dATP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61405 name: trans-tetradec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:85097 ! 4-saturated trans-2-enoyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61406 name: trans-dec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:85100 ! 4,5-saturated-trans-2-enoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61407 name: methoxycinnamic acid is_a: CHEBI:23252 ! cinnamic acids [Term] id: CHEBI:61409 name: dihydroxyphenylacetic acid is_a: CHEBI:25978 ! phenylacetic acids is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:61410 name: oxa fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:61411 name: divinyl ether fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:47985 ! enol ether is_a: CHEBI:61410 ! oxa fatty acid [Term] id: CHEBI:61413 name: oxa fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:61414 name: ferrichromes is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:84688 ! Fe(III)-complexed hydroxamate siderophore [Term] id: CHEBI:61417 name: TDP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61425 name: psicosyllysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:61429 name: dGTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) [Term] id: CHEBI:61430 name: decanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61437 name: fructoselysine 6-phosphate is_a: CHEBI:22529 ! amino sugar phosphate is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:61440 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-D-glucosamine is_a: CHEBI:27392 ! UDP-3-O-(3-hydroxytetradecanoyl)-D-glucosamine [Term] id: CHEBI:61442 name: tetrahydrofolyl-poly(glutamate) polymer is_a: CHEBI:60164 ! ionic polymer relationship: has_part CHEBI:58580 ! tetrahydrofolyl-poly(glutamate) macromolecule [Term] id: CHEBI:61444 name: gamma-poly(glutamate) polymer is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61445 ! poly(amide) polymer relationship: has_part CHEBI:53376 ! gamma-poly(glutamate) macromolecule [Term] id: CHEBI:61445 name: poly(amide) polymer is_a: CHEBI:60027 ! polymer relationship: has_part CHEBI:53224 ! poly(amide) macromolecule [Term] id: CHEBI:61449 name: (2E,4Z)-2-hydroxy-6-oxonona-2,4-dienedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:19615 ! 2-hydroxy-6-oxonona-2,4-dienedioate [Term] id: CHEBI:61450 name: (2E,4Z,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:58637 ! 2-hydroxy-6-oxonona-2,4,7-trienedioate [Term] id: CHEBI:61451 name: (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate subset: chebi_ph7_3 is_a: CHEBI:60108 ! 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate [Term] id: CHEBI:61452 name: poly(ethylene terephthalate) polymer is_a: CHEBI:60160 ! polyester polymer relationship: has_part CHEBI:53259 ! poly(ethylene terephthalate) macromolecule [Term] id: CHEBI:61454 name: GDP-beta-L-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:58355 ! GDP-L-galactose(2-) [Term] id: CHEBI:61455 name: UDP-beta-L-arabinopyranose is_a: CHEBI:17983 ! UDP-L-arabinose [Term] id: CHEBI:61457 name: UDP-beta-L-arabinopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61460 name: UDP-beta-L-arabinofuranose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:61462 name: (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid is_a: CHEBI:49071 ! 3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid [Term] id: CHEBI:61463 name: UDP-beta-L-arabinofuranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61467 name: (2E,4Z,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioic acid is_a: CHEBI:31082 ! 2-hydroxy-6-oxonona-2,4,7-trienedioic acid [Term] id: CHEBI:61469 name: polyanionic polymer is_a: CHEBI:60164 ! ionic polymer relationship: has_part CHEBI:53309 ! polyanionic macromolecule [Term] id: CHEBI:61470 name: (2E,4Z)-2-hydroxy-6-oxonona-2,4-dienedioic acid is_a: CHEBI:17367 ! 2-hydroxy-6-oxonona-2,4-dienedioic acid [Term] id: CHEBI:61472 name: all-trans-6-methoxy-2-hexaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:84166 ! 2-methoxy-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:61473 name: all-trans-5-methoxy-2-methyl-3-hexaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:84167 ! 2-methoxy-3-methyl-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:61478 name: germacrene C subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36743 ! germacrene [Term] id: CHEBI:61481 name: dCTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) [Term] id: CHEBI:61494 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-N-acetylglucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61495 name: beta-D-ManNAcA-(1->4)-alpha-D-GlcNAc-1-diphospho-ditrans,polycis-undecaprenol(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61496 name: alpha-D-FucNAc4-(1->4)-beta-D-ManNAcA-(1->4)-D-GlcNAc-undecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61498 name: epoxy fatty acid is_a: CHEBI:23931 ! epoxy monocarboxylic acid is_a: CHEBI:48847 ! heterocyclic fatty acid [Term] id: CHEBI:615 name: 1-carbapenem-3-carboxylic acid is_a: CHEBI:46634 ! carbapenemcarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:61502 name: heptosyl-(KDO)2-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:193068 ! an L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61505 name: cyanidin 3-O-(2-O-beta-D-glucuronosyl)-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:61506 name: ADP-L-glycero-beta-D-manno-heptose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61507 name: (heptosyl)2-(KDO)2-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:193069 ! an L-alpha-D-Hep-(1->3)-L-alpha-D-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6)-lipid A(6-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61508 name: gamma-glutamyl-gamma-aminobutyraldehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:61509 name: N-acetyl-L-2-aminoadipate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:6151 name: (3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid is_a: CHEBI:27391 ! 1-pyrroline-3-hydroxy-5-carboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61510 name: N-acetyl-L-2-aminoadipate 6-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:61511 name: N-acetyl-L-2-aminoadipate semialdehyde subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:61512 name: N(2)-acetyl-L-lysine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61513 name: gamma-butyrobetainyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:61515 name: N-acetyl-L-2-aminoadipic acid semialdehyde is_a: CHEBI:21545 ! N-acetyl-L-amino acid [Term] id: CHEBI:61517 name: gamma-butyrobetainyl-CoA is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:61519 name: D-psicose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61520 name: (KDO)2-(palmitoleoyl)-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:193149 ! an acyl-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(6-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61521 name: gamma-glutamyl-gamma-aminobutyraldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:61522 name: (KDO)2-(palmitoleoyl-myristoyl)-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61523 name: (heptosyl)2-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:61524 name: (KDO)2-(lauroyl)-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:176430 ! a (Kdo)2-(acyl)-lipid IVA(6-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61526 name: (E)-hexadec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61527 name: D-fructofuranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:61528 name: heptosyl-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:61529 name: alpha-L-Fucp-(1->2)-beta-D-Galp subset: chebi_ph7_3 is_a: CHEBI:62857 ! alpha-L-Fucp-(1->2)-D-Galp relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:61530 name: ADP-L-glycero-beta-D-manno-heptose is_a: CHEBI:15915 ! ADP-L-glycero-D-manno-heptose [Term] id: CHEBI:61533 name: alpha-D-FucNAc4-(1->4)-beta-D-ManNAcA-(1->4)-D-GlcNAc-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61537 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-N-acetyl-alpha-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:61540 name: palmitoleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61543 name: undecaprenyldiphospho-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide [Term] id: CHEBI:61548 name: D-glucopyranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:61567 ! D-hexopyranose 6-phosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61553 name: D-fructofuranose 6-phosphate is_a: CHEBI:78697 ! D-fructose 6-phosphate [Term] id: CHEBI:61555 name: dUTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61560 ! 2'-deoxyribonucleoside 5'-triphosphate(4-) [Term] id: CHEBI:61556 name: (KDO)2-(palmitoleoyl-myristoyl)-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:61557 name: nucleoside 5'-triphoshate(4-) subset: chebi_ph7_3 is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:61558 name: (KDO)2-(palmitoleoyl)-lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:61559 name: D-psicose 6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:61560 name: 2'-deoxyribonucleoside 5'-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:61561 name: beta-D-ManNAcA-(1->4)-alpha-D-GlcNAc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:61562 name: dTDP-4-acetamido-4,6-dideoxy-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:61563 name: farnesyl triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61564 name: L-alanyl-gamma-D-glutamyl-meso-diaminopimelic acid is_a: CHEBI:47923 ! tripeptide relationship: has_role CHEBI:194467 ! NOD1 agonist [Term] id: CHEBI:61565 name: L-alanyl-L-glutamic acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:61566 name: L-alanyl-D-glutamic acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:61567 name: D-hexopyranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61572 name: digalactosylglycerol is_a: CHEBI:24406 ! glycosylglycerol [Term] id: CHEBI:61574 name: D-glycero-alpha-D-manno-heptose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:60002 ! D-glycero-D-manno-heptose 1-phosphate(2-) [Term] id: CHEBI:61575 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36542 ! sialopentaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:61586 name: S-(hydroxymethyl)mycothiol subset: chebi_ph7_3 is_a: CHEBI:37449 ! 2-deoxy-alpha-D-glucoside [Term] id: CHEBI:61589 name: 4-phospho-(KDO)-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:193140 ! a 4-O-phospho-alpha-Kdo-(2->6)-lipid IVA(7-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:61593 name: D-glycero-beta-D-manno-heptose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:60002 ! D-glycero-D-manno-heptose 1-phosphate(2-) [Term] id: CHEBI:61596 name: alpha-Neu5Ac-(2->3)-D-Gal is_a: CHEBI:22480 ! amino disaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:61599 name: [8)-alpha-Neu5Ac-(2->]n is_a: CHEBI:22483 ! amino oligosaccharide [Term] id: CHEBI:61610 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:90357 ! beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:61623 name: fluoroacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:61631 name: N-acetyl-beta-D-glucosaminide subset: chebi_ph7_3 is_a: CHEBI:28401 ! N-acetyl-D-glucosaminide [Term] id: CHEBI:61645 name: L-seryl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:616459 name: carbamimidoylazanium is_a: CHEBI:35359 ! carboxamidine [Term] id: CHEBI:61646 name: fluoroacetyl-CoA is_a: CHEBI:62048 ! haloacyl-CoA [Term] id: CHEBI:61655 name: steroid saponin is_a: CHEBI:26605 ! saponin is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:61660 name: organic sulfamate oxoanion subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:61661 name: dTDP-4-acetamido-4,6-dideoxy-D-galactose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:61662 name: 2'-deoxyribonucleoside triphosphate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61663 name: alpha-D-Manp-(1->3)-alpha-D-Manp subset: chebi_ph7_3 is_a: CHEBI:35318 ! glycosylmannose [Term] id: CHEBI:61664 name: 3-O-(6-O-alpha-D-xylosylphospho-alpha-D-mannopyranosyl)-alpha-D-mannopyranose is_a: CHEBI:27349 ! xylose phosphate [Term] id: CHEBI:61665 name: 3-O-(6-O-alpha-D-xylosylphospho-alpha-D-mannopyranosyl)-alpha-D-mannopyranose(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61666 name: amidobenzoate is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:61667 name: D-hexopyranose 6-phosphate is_a: CHEBI:4195 ! D-hexose 6-phosphate [Term] id: CHEBI:61668 name: oroxylin A is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor [Term] id: CHEBI:61669 name: 2-methylbutanenitrile subset: chebi_ph7_3 is_a: CHEBI:80291 ! aliphatic nitrile [Term] id: CHEBI:61670 name: oroxylin A 7-O-beta-D-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38687 ! monohydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:61672 name: dihydrocarvones is_a: CHEBI:23048 ! carvones [Term] id: CHEBI:61674 name: oroxylin A 7-O-beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:61677 name: (+)-alpha-santalene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:61678 name: (+)-endo-beta-bergamotene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35990 ! bridged compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:61679 name: (-)-endo-alpha-bergamotene subset: chebi_ph7_3 is_a: CHEBI:176809 ! cis-alpha-bergamotene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:61680 name: (1S,4aS)-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon [Term] id: CHEBI:61682 name: ubiquinol-8 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol is_a: CHEBI:26253 ! polyprenylhydroquinone relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:61683 name: ubiquinone-8 subset: chebi_ph7_3 is_a: CHEBI:16389 ! ubiquinones relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:61684 name: menaquinol-8 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:61685 name: (+)-cubenene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:61686 name: (+)-epicubenol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:61687 name: cis-muurola-3,5-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:61688 name: cis-muurola-4(14),5-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:61689 name: amino cyclitol is_a: CHEBI:23451 ! cyclitol [Term] id: CHEBI:61690 name: (+)-alpha-barbatene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:61693 name: carboxyalkyl phosphate oxoanion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:61694 name: L-cysteinylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61695 name: L-prolylglycine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:61696 name: L-prolinylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:61697 name: fatty acid derivative is_a: CHEBI:18059 ! lipid [Term] id: CHEBI:61698 name: L-ascorbate 6-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:616988 name: mannose 6-phosphate is_a: CHEBI:21060 ! mannose phosphate [Term] id: CHEBI:61699 name: (-)-alpha-gurjunene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:61700 name: (+)-valencene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:61701 name: L-ascorbic acid 6-phosphate is_a: CHEBI:37429 ! aldonolactone phosphate [Term] id: CHEBI:61702 name: dinoflagellate luciferin is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:36736 ! bilenes is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:25078 ! luciferin [Term] id: CHEBI:61703 name: nonclassic icosanoid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:61704 name: oxoicosatetraenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:61705 name: 3-demethylubiquinol-8 subset: chebi_ph7_3 is_a: CHEBI:84422 ! 3-demethylubiquinol [Term] id: CHEBI:61706 name: dinoflagellate luciferin(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:61707 name: oxidized dinoflagellate luciferin is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:36736 ! bilenes is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:25747 ! oxidized luciferins [Term] id: CHEBI:61708 name: oxidized dinoflagellate luciferin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:61717 name: ferroheme c(2-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:61720 name: bacteriochlorophyll a(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:61721 name: chlorophyll b(1-) subset: chebi_ph7_3 is_a: CHEBI:139291 ! chlorophyll(1-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:61722 name: 2-pentenal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde [Term] id: CHEBI:61723 name: D-pantetheine 4'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:47942 ! pantetheine 4'-phosphate(2-) relationship: has_role CHEBI:26348 ! prosthetic group [Term] id: CHEBI:61725 name: oct-2-enal subset: chebi_ph7_3 is_a: CHEBI:13757 ! n-alk-2-enal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde [Term] id: CHEBI:61727 name: 2-decenal subset: chebi_ph7_3 is_a: CHEBI:134219 ! decenals is_a: CHEBI:51688 ! enal [Term] id: CHEBI:61732 name: beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer is_a: CHEBI:36541 ! sialotriaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:61734 name: lipid IIA(3-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61735 name: lipid IIA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:61736 name: thujopsene is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:61737 name: (+)-thujopsene subset: chebi_ph7_3 is_a: CHEBI:61736 ! thujopsene [Term] id: CHEBI:61744 name: beta-chamigrene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:61746 name: (+)-beta-chamigrene subset: chebi_ph7_3 is_a: CHEBI:61744 ! beta-chamigrene [Term] id: CHEBI:61748 name: (E)-oct-2-enal subset: chebi_ph7_3 is_a: CHEBI:61725 ! oct-2-enal relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:61760 name: D-mannosyl ditrans,polycis-undecaprenyl phosphate is_a: CHEBI:21060 ! mannose phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:61761 name: D-mannosyl ditrans,polycis-undecaprenyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61777 name: terpene glycoside is_a: CHEBI:24400 ! glycoside is_a: CHEBI:26873 ! terpenoid [Term] id: CHEBI:61778 name: triterpenoid saponin is_a: CHEBI:26605 ! saponin is_a: CHEBI:61777 ! terpene glycoside [Term] id: CHEBI:6178 name: L-arabinofuranose subset: chebi_ph7_3 is_a: CHEBI:30849 ! L-arabinose [Term] id: CHEBI:61796 name: dinoflagellate luciferin(1-) subset: chebi_ph7_3 is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:61799 name: beta-D-galactopyranosyl diglyceride subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid is_a: CHEBI:63425 ! galactosylglycerol derivative [Term] id: CHEBI:61817 name: 1-palmitoyl-2-azelaoyl-sn-glycero-3-phosphocholine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:61820 name: beta-D-Gal-(1->3)-alpha-D-GalNAc subset: chebi_ph7_3 is_a: CHEBI:146500 ! D-Galp-(1->3)-D-GalpNAc is_a: CHEBI:546807 ! beta-D-Galp-(1->3)-D-GalpNAc [Term] id: CHEBI:61822 name: 2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:61870 name: monounsaturated fatty aldehyde is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:61873 name: 2-demethylmenaquinol-8 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:61887 name: N-acetylglycinate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:61891 name: N(5)-methyl-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61896 name: N(omega),N(omega)-dimethyl-L-arginine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61897 name: N(omega),N(omega)-dimethyl-L-arginine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:61898 name: alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide is_a: CHEBI:22485 ! glucosamine oligosaccharide [Term] id: CHEBI:61900 name: alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61901 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61902 name: hydroxy fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:61903 name: oxo-fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:61904 name: isethionate subset: chebi_ph7_3 is_a: CHEBI:62081 ! 1,1-diunsubstituted alkanesulfonate [Term] id: CHEBI:61905 name: short-chain fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:61906 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61907 name: medium-chain fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:61908 name: EC 1.14.13.39 (nitric oxide synthase) inhibitor is_a: CHEBI:76841 ! EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor [Term] id: CHEBI:61909 name: ethanesulfonate subset: chebi_ph7_3 is_a: CHEBI:62081 ! 1,1-diunsubstituted alkanesulfonate [Term] id: CHEBI:61910 name: very long-chain fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:61911 name: butane-1-sulfonate subset: chebi_ph7_3 is_a: CHEBI:62081 ! 1,1-diunsubstituted alkanesulfonate [Term] id: CHEBI:61912 name: branched-chain fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:61915 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61919 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61921 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61925 name: alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61927 name: alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61928 name: N(6)-methyl-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61929 name: N(6)-methyl-L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:61930 name: N(6)-acetyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:137967 ! N(6)-acyl-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61931 name: glycerol 1-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61932 name: alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol) is_a: CHEBI:15926 ! dolichyl diphosphooligosaccharide [Term] id: CHEBI:61933 name: glycerophosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61935 name: alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61936 name: gamma-carboxy-L-glutamic acid zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:61937 name: alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61938 name: gamma-carboxy-L-glutamic acid zwitterion(2-) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:36300 ! tricarboxylic acid dianion [Term] id: CHEBI:61939 name: gamma-carboxy-L-glutamic acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61940 name: aroyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:61941 name: gamma-carboxy-L-glutamic acid(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:61942 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61943 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61944 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61945 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61946 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61947 name: alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61948 name: alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61949 name: alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc(PP-Dol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57570 ! dolichyl diphosphooligosaccharide(2-) [Term] id: CHEBI:61950 name: microtubule-stabilising agent is_a: CHEBI:60832 ! tubulin modulator [Term] id: CHEBI:61951 name: microtubule-destabilising agent is_a: CHEBI:60832 ! tubulin modulator is_a: CHEBI:64911 ! antimitotic [Term] id: CHEBI:61952 name: alpha-maltopentaose subset: chebi_ph7_3 is_a: CHEBI:61996 ! maltopentaose pentasaccharide [Term] id: CHEBI:61953 name: alpha-maltohexaose subset: chebi_ph7_3 is_a: CHEBI:62007 ! maltohexaose hexasaccharide [Term] id: CHEBI:61954 name: alpha-maltoheptaose subset: chebi_ph7_3 is_a: CHEBI:62009 ! maltoheptaose heptasaccharide [Term] id: CHEBI:61958 name: butane-1-sulfonic acid is_a: CHEBI:47901 ! alkanesulfonic acid [Term] id: CHEBI:61961 name: N(6),N(6),N(6)-trimethyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:61962 name: S-oxy-L-cysteine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61963 name: 3-disulfanyl-L-alanine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61964 name: L-cysteine-S-dioxide residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61965 name: trans-4-hydroxy-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61966 name: metabotropic glutamate receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:61967 name: 3-sulfino-L-alanine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61968 name: cis-tetradec-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:85489 ! cis-3-enoyl-CoA(4-) [Term] id: CHEBI:61969 name: N(6),N(6)-dimethyl-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61970 name: N-acetyl-alpha-D-galactosamine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:140358 ! monosaccharide 1-phosphate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61971 name: O-phospho-L-threonine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61972 name: O(4)-phospho-L-tyrosine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61973 name: S-hydroxy-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:61974 name: 3-sulfino-L-alanine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:61976 name: N(6),N(6)-dimethyl-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:61977 name: O-phosphonato-L-threonine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:61978 name: O(4)-phosphonato-L-tyrosine(2-) residue is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:6198 name: (S)-azetidine-2-carboxylic acid is_a: CHEBI:38108 ! azetidine-2-carboxylic acid [Term] id: CHEBI:61982 name: (E)-2-methylgeranyl diphosphate is_a: CHEBI:46731 ! alkyl diphosphate [Term] id: CHEBI:61983 name: L-Ala-gamma-D-Glu-meso-Dap-D-Ala(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:61984 name: (E)-2-methylgeranyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:61985 name: 4-carboxy-2-hydroxymuconate semialdehyde hemiacetal(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:61986 name: maltotetraose tetrasaccharide is_a: CHEBI:147369 ! glucotetraose is_a: CHEBI:17593 ! maltooligosaccharide [Term] id: CHEBI:61987 name: 2-methylisoborneol subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:61988 name: alpha-maltotetraose subset: chebi_ph7_3 is_a: CHEBI:61986 ! maltotetraose tetrasaccharide [Term] id: CHEBI:61990 name: 15,9'-di-cis-phytofluene subset: chebi_ph7_3 is_a: CHEBI:26120 ! phytofluene [Term] id: CHEBI:61991 name: maltotriose trisaccharide is_a: CHEBI:17593 ! maltooligosaccharide is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:61992 name: sulfoacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:61993 name: maltotriose subset: chebi_ph7_3 is_a: CHEBI:61991 ! maltotriose trisaccharide [Term] id: CHEBI:61994 name: sulfoacetyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:61996 name: maltopentaose pentasaccharide is_a: CHEBI:149465 ! glucopentaose is_a: CHEBI:17593 ! maltooligosaccharide [Term] id: CHEBI:61997 name: glucosyl-(heptosyl)2-(KDO)2-lipid A(6-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61998 name: glucosyl-heptosyl-4-phosphonatoheptosyl-(KDO)2-lipid A(8-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:61999 name: glucosyl-(heptosyl)2-4-phosphonatoheptosyl-(KDO)2-lipid A(8-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62000 name: glucosyl-heptosyl-(phosphonatoheptosyl)2-(KDO)2-lipid A(10-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62001 name: galactosyl-glucosyl-heptosyl-(phosphonatoheptosyl)2-(KDO)2-lipid A(10-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62002 name: galactosyl-(glucosyl)2-(heptosyl)3-(KDO)2-lipid A-bisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62003 name: galactosyl-(glucosyl)3-(heptosyl)3-(KDO)2-lipid A-bisphosphate(10-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62004 name: lipid A-core(10-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:62006 name: maltopentaose subset: chebi_ph7_3 is_a: CHEBI:61996 ! maltopentaose pentasaccharide [Term] id: CHEBI:62007 name: maltohexaose hexasaccharide is_a: CHEBI:157698 ! glucohexaose is_a: CHEBI:17593 ! maltooligosaccharide [Term] id: CHEBI:62009 name: maltoheptaose heptasaccharide is_a: CHEBI:17593 ! maltooligosaccharide is_a: CHEBI:53463 ! heptasaccharide [Term] id: CHEBI:62010 name: maltoheptaose subset: chebi_ph7_3 is_a: CHEBI:62009 ! maltoheptaose heptasaccharide [Term] id: CHEBI:62011 name: 4-carboxy-2-hydroxymuconate semialdehyde hemiacetal is_a: CHEBI:26407 ! pyrans is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:38131 ! lactol [Term] id: CHEBI:62012 name: 5-deoxy-D-ribose subset: chebi_ph7_3 is_a: CHEBI:23635 ! deoxypentose [Term] id: CHEBI:62013 name: glycerol 1-phosphoserine is_a: CHEBI:55491 ! glycerol 1-phosphodiester is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:62014 name: cis-tetradec-3-enoyl-CoA is_a: CHEBI:26900 ! tetradecenoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:62015 name: L-Ala-gamma-D-Glu-meso-Dap-D-Ala is_a: CHEBI:48030 ! tetrapeptide [Term] id: CHEBI:62016 name: glucosyl-(heptosyl)2-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62017 name: glucosyl-heptosyl-4-phosphoheptosyl-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62031 name: polar amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62037 name: beta-D-Manp-(1->2)-D-Manp subset: chebi_ph7_3 is_a: CHEBI:35318 ! glycosylmannose [Term] id: CHEBI:62041 name: P(1),P(5)-bis(5'-adenosyl) pentaphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62046 name: biotinate sulfoxide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62047 name: (S)-carnitinyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:62048 name: haloacyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:62049 name: acyl donor is_a: CHEBI:17891 ! donor [Term] id: CHEBI:62055 name: deoxy oligosaccharide is_a: CHEBI:23639 ! deoxy sugar is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:62064 name: butane-2,3-diol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:52684 ! butanediol [Term] id: CHEBI:62065 name: chondroitin 6'-sulfate anion subset: chebi_ph7_3 is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:62069 name: phaseic acid anion subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62071 name: 2-cis-abscisate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62432 ! abscisates [Term] id: CHEBI:62072 name: naptalamate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62074 name: 3-chloroacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62075 name: (S)-3-hydroxyhexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:62077 name: trans-hex-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:62081 name: 1,1-diunsubstituted alkanesulfonate subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion is_a: CHEBI:33554 ! organosulfonate oxoanion relationship: has_role CHEBI:35703 ! xenobiotic [Term] id: CHEBI:62089 name: EC 1.4.7.1 [glutamate synthase (ferredoxin)] inhibitor is_a: CHEBI:76730 ! EC 1.4.* (oxidoreductase acting on donor CH-NH2 group) inhibitor [Term] id: CHEBI:62090 name: germacra-1(10),4,11(13)-trien-12-ol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:62091 name: germacra-1(10),4,11(13)-trien-12-al subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:62111 name: 6-O-acetyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:17901 ! 6-O-acetyl-D-glucose [Term] id: CHEBI:62117 name: 6beta-hydroxyprogesterone subset: chebi_ph7_3 is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:62130 name: beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:59412 ! amino tetrasaccharide [Term] id: CHEBI:62141 name: S-[(2E,6E)-farnesyl]-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:137935 ! S-polyprenyl-L-cysteine zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62150 name: (3,4-dimethoxyphenyl)methanol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:51681 ! dimethoxybenzene relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:62164 name: N-acetylmannosamine is_a: CHEBI:25166 ! mannosamine [Term] id: CHEBI:62170 name: N-acyl-D-mannosamine phosphate is_a: CHEBI:25165 ! mannosamine phosphate [Term] id: CHEBI:62192 name: plastoquinol subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:62193 name: biotin sulfoxide is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:51570 ! biotins relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62194 name: (S)-carnitinyl-CoA betaine is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:35284 ! ammonium betaine [Term] id: CHEBI:62196 name: polysaccharide acid oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62197 name: S-[(2E,6E)-farnesyl]-L-cysteine is_a: CHEBI:22043 ! S-farnesyl-L-cysteine [Term] id: CHEBI:62198 name: lipid A-core is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62199 name: galactosyl-(glucosyl)3-(heptosyl)3-(KDO)2-lipid A-bisphosphate is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:62200 name: galactosyl-(glucosyl)2-(heptosyl)3-(KDO)2-lipid A-bisphosphate is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:62201 name: galactosyl-glucosyl-heptosyl-(phosphoheptosyl)2-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62202 name: glucosyl-heptosyl-(phosphoheptosyl)2-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62203 name: glucosyl-(heptosyl)2-4-phosphoheptosyl-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62205 name: 3-methylxanthine is_a: CHEBI:62206 ! monomethylxanthine relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:62206 name: monomethylxanthine is_a: CHEBI:25348 ! methylxanthine [Term] id: CHEBI:62207 name: 3-methyl-9H-xanthine subset: chebi_ph7_3 is_a: CHEBI:62205 ! 3-methylxanthine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62208 name: 3-methyl-7H-xanthine subset: chebi_ph7_3 is_a: CHEBI:62205 ! 3-methylxanthine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62209 name: CoA-disulfide(8-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62210 name: 5-hydroxypyrrole-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26452 ! pyrrolecarboxylate [Term] id: CHEBI:62211 name: 3-butynoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62212 name: 5-hydroxypyrrole-2-carboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid [Term] id: CHEBI:62213 name: D-4-hydroxy-2-oxoglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:17742 ! 4-hydroxy-2-oxoglutarate(2-) [Term] id: CHEBI:62214 name: 5-hydroxykynurenaminium(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:62215 name: allelochemical is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:62216 name: 1-hydroxyphenazine subset: chebi_ph7_3 is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:62217 name: 23,24-dihydrocucurbitacin B subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:17320 ! 23,24-dihydrocucurbitacin is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:62219 name: 2-heptyl-4-quinolone subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:62220 name: pyocyanine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:39201 ! phenazines [Term] id: CHEBI:62221 name: 5-methylphenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35285 ! iminium betaine is_a: CHEBI:36674 ! phenazine [Term] id: CHEBI:62222 name: 4-methyl-3-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62223 name: 2-(beta-D-glucosyloxy)-cis-cinnamate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:62224 name: (-)-7-epi-alpha-selinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:49272 ! selinene [Term] id: CHEBI:62225 name: S-sulfo-L-cysteinate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:62226 name: L-selenocystathionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62227 name: L-adenosylselenomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:62230 name: GDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:138068 ! ribonucleoside 5'-diphosphate-alpha-D-glucose(2-) is_a: CHEBI:58127 ! GDP-D-glucose(2-) [Term] id: CHEBI:62231 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)3-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide [Term] id: CHEBI:62232 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:27194 ! undecaprenyldiphospho-N-acetylmuramoyl peptide [Term] id: CHEBI:62233 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-L-lysyl-D-alanyl-D-alanine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62234 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)-L-lysyl-D-alanyl-D-alanine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62235 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)3-L-lysyl-D-alanyl-D-alanine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62236 name: undecaprenyldiphospho-N-acetyl-(N-acetylglucosaminyl)muramoyl-L-alanyl-D-isoglutaminyl-(glycyl)5-L-lysyl-D-alanyl-D-alanine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62237 name: cardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:76529 ! glycerophosphoglycerophosphoglycerol(2-) [Term] id: CHEBI:62239 name: 3-hydroxydecanoyl-3-hydroxydecanoate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:62241 name: UDP-N-acetyl-beta-L-fucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:62242 name: trans-oct-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:85097 ! 4-saturated trans-2-enoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:62243 name: trans,trans-octa-2,4-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:85111 ! 6-saturated-trans,trans-2,4-dienoyl-CoA(4-) [Term] id: CHEBI:62244 name: trans,trans-deca-2,4-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:85111 ! 6-saturated-trans,trans-2,4-dienoyl-CoA(4-) [Term] id: CHEBI:62245 name: UDP-2-acetamido-3-ammonio-2,3-dideoxy-alpha-D-glucuronate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62246 name: (S)-2-hydroxypropylphosphonate subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62247 name: (1R,2S)-epoxypropylphosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:62248 name: phenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62250 name: UDP-2-acetamido-2-deoxy-alpha-D-ribo-hex-3-uluronate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62251 name: 2-(beta-D-glucosyloxy)-cis-cinnamic acid is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:62254 name: GDP-alpha-D-glucose is_a: CHEBI:17383 ! GDP-D-glucose [Term] id: CHEBI:62259 name: alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:62262 name: isomultiflorenol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:62263 name: alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:62265 name: beta-D-Galp-(1->3)-[alpha-L-Fucp-(1->4)]-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:62286 name: 2'-deoxyinosine 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:73316 ! 2'-deoxyribonucleoside 5'-diphosphate(3-) [Term] id: CHEBI:62287 name: alpha-L-Fucp-(1->3)-[beta-D-Galp-(1->4)]-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:62318 name: D-lyxose is_a: CHEBI:25097 ! lyxose [Term] id: CHEBI:62320 name: L-lyxose is_a: CHEBI:25097 ! lyxose [Term] id: CHEBI:62324 name: D-mannosamine is_a: CHEBI:25166 ! mannosamine is_a: CHEBI:63369 ! D-aldose derivative [Term] id: CHEBI:62327 name: alpha-D-Galp-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:18217 ! alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-D-GlcNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:62338 name: O(4)-phosphonato-L-tyrosine(2-) subset: chebi_ph7_3 is_a: CHEBI:74955 ! O(4)-phosphonatotyrosine(2-) [Term] id: CHEBI:62345 name: L-rhamnose is_a: CHEBI:26546 ! rhamnose [Term] id: CHEBI:62346 name: L-rhamnopyranose subset: chebi_ph7_3 is_a: CHEBI:62345 ! L-rhamnose [Term] id: CHEBI:62370 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:62372 name: UDP-2-acetamido-2,6-dideoxy-beta-L-talose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:62375 name: UDP-2-acetamido-2,6-dideoxy-alpha-D-xylo-hex-4-ulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:62377 name: UDP-2-acetamido-2,6-dideoxy-beta-L-lyxo-hex-4-ulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:62383 name: 1D-myo-inositol 2-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate [Term] id: CHEBI:62406 name: 3-hydroxydecanoyl-3-hydroxydecanoic acid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35868 ! hydroxy monocarboxylic acid [Term] id: CHEBI:62407 name: UDP-N-acetyl-beta-L-fucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:62408 name: trans,trans-octa-2,4-dienoyl-CoA is_a: CHEBI:17157 ! trans,trans-2,3,4,5-tetradehydroacyl-CoA [Term] id: CHEBI:62409 name: trans,trans-deca-2,4-dienoyl-CoA is_a: CHEBI:17157 ! trans,trans-2,3,4,5-tetradehydroacyl-CoA [Term] id: CHEBI:62410 name: UDP-2-acetamido-3-amino-2,3-dideoxy-alpha-D-glucuronic acid is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:62411 name: UDP-2-acetamido-2,6-dideoxy-beta-L-talose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:62412 name: phenazine-1-carboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33859 ! aromatic carboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:62413 name: (S)-methylmalonate semialdehyde subset: chebi_ph7_3 is_a: CHEBI:57700 ! 2-methyl-3-oxopropanoate [Term] id: CHEBI:62414 name: biotinyl-5'-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:62416 name: dammarenediol-II subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62417 name: arabidiol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:52340 ! tricyclic triterpenoid [Term] id: CHEBI:62418 name: 3-oxohexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62419 name: (1R,2S)-epoxypropylphosphonate(2-) is_a: CHEBI:71285 ! organophosphonate(2-) [Term] id: CHEBI:62420 name: UDP-2-acetamido-2,6-dideoxy-alpha-D-xylo-hex-4-ulose is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:62421 name: (S)-2-trans-abscisate subset: chebi_ph7_3 is_a: CHEBI:62429 ! 2-trans-abscisate [Term] id: CHEBI:62423 name: (2-hydroxyphenyl)acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:62424 name: UDP-2-acetamido-2-deoxy-alpha-D-ribo-hex-3-uloseuronic acid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:62426 name: 2-trans-abscisic acid is_a: CHEBI:62431 ! abscisic acids [Term] id: CHEBI:62428 name: UDP-2-acetamido-2,6-dideoxy-beta-L-lyxo-hex-4-ulose is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:62429 name: 2-trans-abscisate subset: chebi_ph7_3 is_a: CHEBI:62432 ! abscisates [Term] id: CHEBI:62431 name: abscisic acids is_a: CHEBI:134397 ! tertiary allylic alcohol is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:62432 name: abscisates subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62433 name: (R)-2-trans-abscisate subset: chebi_ph7_3 is_a: CHEBI:62429 ! 2-trans-abscisate [Term] id: CHEBI:62436 name: (+)-abscisic acid D-glucopyranosyl ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35436 ! D-glucoside [Term] id: CHEBI:62437 name: (S)-2-trans-abscisic acid beta-D-glucopyranosyl ester subset: chebi_ph7_3 is_a: CHEBI:62438 ! (S)-2-trans-abscisic acid D-glucopyranosyl ester [Term] id: CHEBI:62438 name: (S)-2-trans-abscisic acid D-glucopyranosyl ester subset: chebi_ph7_3 is_a: CHEBI:133910 ! 2-trans-abscisic acid D-glucosyl ester [Term] id: CHEBI:62439 name: soyasapogenol B 3-O-beta-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:61778 ! triterpenoid saponin [Term] id: CHEBI:62440 name: soyasapogenol A subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:62441 name: soyasapogenol B 3-O-beta-glucuronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62442 name: soyasapogenol A 3-O-beta-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:61778 ! triterpenoid saponin [Term] id: CHEBI:62443 name: soyasapogenol A 3-O-beta-glucuronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62444 name: soyasapogenol E subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:62445 name: soyasapogenol E 3-O-beta-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:61778 ! triterpenoid saponin [Term] id: CHEBI:62446 name: soyasapogenol E 3-O-beta-glucuronate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62447 name: dammara-20,24-diene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:35341 ! steroid [Term] id: CHEBI:62448 name: indole-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62449 name: 4,4'-diapolycopene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:62450 name: 4,4'-diapolycopenedial subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:62452 name: camelliol C subset: chebi_ph7_3 is_a: CHEBI:33661 ! monocyclic compound is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:62455 name: germanicol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:62456 name: cucurbitadienol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid [Term] id: CHEBI:62457 name: (17Z)-protosta-17(20),24-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62458 name: sophoradiol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:62459 name: 24-hydroxy-beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:62460 name: helvolic acid is_a: CHEBI:20156 ! 3-oxo-Delta(1) steroid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:47891 ! steroid acid relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:62461 name: helvolate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:62462 name: isoguanine subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine [Term] id: CHEBI:62463 name: 7,9,9'-tri-cis-neurosporene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:62464 name: O-(3-O-beta-D-galactosyl-N-acetyl-alpha-D-galactosaminyl)-L-serine is_a: CHEBI:21957 ! O-glycosyl-L-serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:62465 name: O-(3-O-beta-D-galactosyl-N-acetyl-alpha-D-galactosaminyl)-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62466 name: 7,7',9,9'-tetra-cis-lycopene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:62474 name: all-trans-3,4-didehydrolycopene subset: chebi_ph7_3 is_a: CHEBI:35162 ! acyclic carotene [Term] id: CHEBI:62476 name: 2-O-(4-deoxy-beta-L-threo-hex-4-enopyranuronosyl)-alpha-L-rhamnopyranose is_a: CHEBI:24592 ! hexuronic acid is_a: CHEBI:55333 ! glycosylrhamnose [Term] id: CHEBI:62478 name: 2-O-(4-deoxy-beta-L-threo-hex-4-enopyranuronosyl)-alpha-L-rhamnopyranose(1-) subset: chebi_ph7_3 is_a: CHEBI:24591 ! hexuronate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62480 name: spheroiden-2-one subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:62481 name: (3E)-3,4-didehydrorhodopin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:62488 name: signalling molecule is_a: CHEBI:33280 ! molecular messenger [Term] id: CHEBI:62490 name: sphingomyelin d18:1(1+) is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:62495 name: D-glucosylsphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:62497 name: 7-(3-methylbut-2-enyl)-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62499 name: methyl-branched fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid [Term] id: CHEBI:62500 name: methacrylyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:62501 name: folate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:67011 ! folates relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:62505 name: demethylspheroidene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol [Term] id: CHEBI:62508 name: eudesmane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:62509 name: 2-O-(alpha-D-glucopyranosyl)-D-glyceric acid is_a: CHEBI:22390 ! alpha-D-glucoside is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:62510 name: 2-O-(alpha-D-glucopyranosyl)-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:22390 ! alpha-D-glucoside is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:62514 name: 10-epi-gamma-eudesmol subset: chebi_ph7_3 is_a: CHEBI:62508 ! eudesmane sesquiterpenoid relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:62517 name: tricarballylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:62519 name: (2S,3S,5R,10R,12S,14S,15R,16R)-2-amino-12,16-dimethylicosane-3,5,10,14,15-pentol is_a: CHEBI:37205 ! pentol is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:62521 name: trans-permethrin is_a: CHEBI:34911 ! permethrin [Term] id: CHEBI:62523 name: (-)-trans-permethrin subset: chebi_ph7_3 is_a: CHEBI:62521 ! trans-permethrin [Term] id: CHEBI:62526 name: (2S,3S,5R,10R,12S,14S,15R,16R)-2-amino-12,16-dimethylicosane-3,5,10,14,15-pentol(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:62527 name: (3-phenoxyphenyl)methanol subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:62528 name: (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid is_a: CHEBI:39308 ! 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid [Term] id: CHEBI:62531 name: (1S,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62533 name: oligogalacturonide is_a: CHEBI:24151 ! galactooligosaccharide [Term] id: CHEBI:62537 name: N-acylphosphatidylethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:62543 name: 3-oxotetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:62545 name: acyl alpha,alpha-trehalose is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:62546 name: monoacyl alpha,alpha-trehalose is_a: CHEBI:62545 ! acyl alpha,alpha-trehalose [Term] id: CHEBI:62547 name: polyacyl alpha,alpha-trehalose is_a: CHEBI:62545 ! acyl alpha,alpha-trehalose [Term] id: CHEBI:62548 name: 3-oxodecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:62549 name: acyl alpha,alpha-trehalose derivative is_a: CHEBI:166828 ! saccharolipid is_a: CHEBI:33563 ! glycolipid [Term] id: CHEBI:62552 name: polyacyl alpha,alpha-trehalose derivative is_a: CHEBI:62549 ! acyl alpha,alpha-trehalose derivative [Term] id: CHEBI:62554 name: fumonisin B1(3-) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:35754 ! tetracarboxylic acid anion [Term] id: CHEBI:62555 name: 3-hydroxyisovaleryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:62558 name: (S)-3-hydroxylauroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:191200 ! medium-chain (3S)-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:62563 name: cellooligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:62566 name: CDP-1L-myo-inositol is_a: CHEBI:47784 ! nucleotide conjugate [Term] id: CHEBI:62571 name: beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:140691 ! beta-D-Gal-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer relationship: has_part CHEBI:142568 ! beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->4)-beta-D-Galp-yl group relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:62573 name: CDP-1L-myo-inositol(2-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:62574 name: bis(1L-myo-inositol) 3,1'-phosphate 1-phosphate is_a: CHEBI:24846 ! inositol phosphate [Term] id: CHEBI:62576 name: bis(1L-myo-inositol) 3,1'-phosphate 1-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:62600 name: 2-O-(alpha-D-glucopyranosyl)-3-O-phosphonato-D-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62601 name: 2-O-(alpha-D-glucopyranosyl)-3-O-phospho-D-glyceric acid is_a: CHEBI:22390 ! alpha-D-glucoside is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:62602 name: 2-O-[alpha-D-mannopyranosyl-(1->2)-alpha-D-glucopyranosyl]-3-O-phosphonato-D-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62603 name: 2-O-[alpha-D-mannopyranosyl-(1->2)-alpha-D-glucopyranosyl]-3-O-phospho-D-glyceric acid is_a: CHEBI:24400 ! glycoside is_a: CHEBI:36952 ! carboxyalkyl phosphate is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:62608 name: EC 4.2.1.3 (aconitate hydratase) inhibitor is_a: CHEBI:76907 ! EC 4.2.1.* (hydro-lyases) inhibitor [Term] id: CHEBI:62609 name: EC 3.11.1.3 (phosphonopyruvate hydrolase) inhibitor is_a: CHEBI:76883 ! EC 3.11.1.* (hydrolases acting on C-P bonds of phosphono-acetaldehyde, -acetate, or -pyruvate) inhibitor [Term] id: CHEBI:62611 name: (S)-3-hydroxyisobutyryl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:62612 name: (3R,5S)-1-pyrroline-3-hydroxy-5-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26457 ! 1-pyrrolinecarboxylate [Term] id: CHEBI:62613 name: (S)-3-hydroxypalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136757 ! long-chain (3S)-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:62614 name: (S)-3-hydroxytetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136757 ! long-chain (3S)-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:62615 name: 3-oxolauroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:62616 name: (S)-3-hydroxydecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:86041 ! 3-hydroxydecanoyl-CoA(4-) [Term] id: CHEBI:62617 name: (S)-3-hydroxyoctanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:86040 ! 3-hydroxyoctanoyl-CoA(4-) [Term] id: CHEBI:62618 name: hydroxyacyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:62619 name: 3-oxooctanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:62620 name: hexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:62621 name: L-selenomethionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:62622 name: (5-hydroxyindol-3-yl)acetate subset: chebi_ph7_3 is_a: CHEBI:38468 ! indol-3-yl carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:62624 name: 5-hydroxy-L-kynurenine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:62626 name: uroporphyrinogen I(8-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:62631 name: coproporphyrinogen I(4-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:62637 name: L-4-hydroxyglutamate semialdehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:62638 name: (S)-3-hydroxyisobutyrate subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:62639 name: 2-cis,6-trans,10-trans-geranylgeranyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62641 name: perillate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62643 name: anionic phospholipid is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62649 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:140714 ! alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1)-Cer is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36642 ! glycohexaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:62651 name: thia-alkylglucosinolate is_a: CHEBI:36445 ! alkylglucosinolate [Term] id: CHEBI:62663 name: hydroxy-alkenylglucosinolate is_a: CHEBI:24279 ! glucosinolate [Term] id: CHEBI:62682 name: inositol phosphomannosylinositol phosphoceramide is_a: CHEBI:26057 ! phosphoglycosphingolipid [Term] id: CHEBI:62727 name: molybdopterin adenine dinucleotide(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62728 name: molybdopterin adenine dinucleotide is_a: CHEBI:37146 ! molybdopterin dinucleotide [Term] id: CHEBI:62729 name: 3-(all-trans-polyprenyl)benzene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:62731 name: 2-methoxy-6-(all-trans-polyprenyl)phenol subset: chebi_ph7_3 is_a: CHEBI:134251 ! guaiacols [Term] id: CHEBI:62732 name: aromatic ester is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:35701 ! ester [Term] id: CHEBI:62733 name: aromatic amide is_a: CHEBI:32988 ! amide is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:62734 name: 2,7-dihydroxy-4'-methoxyisoflavanone subset: chebi_ph7_3 is_a: CHEBI:38131 ! lactol is_a: CHEBI:72739 ! hydroxyisoflavanone is_a: CHEBI:72740 ! methoxyisoflavanone [Term] id: CHEBI:62735 name: lupan-3beta,20-diol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:62736 name: 4,4'-diapophytoene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:48121 ! polyene [Term] id: CHEBI:62738 name: 15-cis-4,4'-diapophytoene subset: chebi_ph7_3 is_a: CHEBI:62736 ! 4,4'-diapophytoene [Term] id: CHEBI:62739 name: 4,4'-diapophytofluene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:48121 ! polyene [Term] id: CHEBI:62740 name: all-trans-4,4'-diapophytofluene subset: chebi_ph7_3 is_a: CHEBI:62739 ! 4,4'-diapophytofluene [Term] id: CHEBI:62741 name: 4,4'-diapo-zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:48121 ! polyene [Term] id: CHEBI:62742 name: all-trans-4,4'-diapo-zeta-carotene subset: chebi_ph7_3 is_a: CHEBI:62741 ! 4,4'-diapo-zeta-carotene [Term] id: CHEBI:62743 name: 4,4'-diaponeurosporene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:48121 ! polyene [Term] id: CHEBI:62745 name: ammoniodiacetate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:62746 name: 2-acyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:62749 ! 2-acylglycerophosphoinositol [Term] id: CHEBI:62747 name: 1-acyl-sn-glycero-3-phosphoglycerol is_a: CHEBI:24360 ! glycerophosphoglycerols [Term] id: CHEBI:62749 name: 2-acylglycerophosphoinositol is_a: CHEBI:36315 ! glycerophosphoinositol [Term] id: CHEBI:62753 name: alpha-longipinene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:62755 name: alpha-bergamotene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35714 ! polycyclic olefin is_a: CHEBI:35990 ! bridged compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:62756 name: (-)-exo-alpha-bergamotene subset: chebi_ph7_3 is_a: CHEBI:62755 ! alpha-bergamotene [Term] id: CHEBI:62759 name: beta-curcumene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:37613 ! cyclohexadiene [Term] id: CHEBI:62760 name: (-)-beta-curcumene subset: chebi_ph7_3 is_a: CHEBI:62759 ! beta-curcumene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:62761 name: tyrosine derivative is_a: CHEBI:25985 ! phenylalanine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:62762 name: (+)-2-epi-prezizaene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:51119 ! tricyclic hydrocarbon [Term] id: CHEBI:62764 name: reactive nitrogen species is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:62765 name: beta-D-glucosyl crocetin is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:62766 name: beta-D-glucosyl crocetin(1-) subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:62767 name: crocetin(2-) subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:62768 name: bis(beta-D-glucosyl) crocetin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:51307 ! diester [Term] id: CHEBI:62769 name: beta-D-gentiobiosyl crocetin is_a: CHEBI:24400 ! glycoside is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:62770 name: beta-D-gentiobiosyl crocetin(1-) subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:62771 name: beta-D-gentiobiosyl beta-D-glucosyl crocetin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:51307 ! diester [Term] id: CHEBI:62776 name: (1->4)-beta-D-galactan subset: chebi_ph7_3 is_a: CHEBI:37165 ! galactan [Term] id: CHEBI:62777 name: maltotriulose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:62780 name: alpha-D-Glcp-(1->3)-alpha-D-Glcp-(1->3)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:146180 ! glucotriose [Term] id: CHEBI:62781 name: alpha-L-Araf-(1->5)-alpha-L-Araf-(1->5)-L-Araf subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:62783 name: beta-D-Xylp-(1->4)-beta-D-Xylp-(1->4)-D-Xylp subset: chebi_ph7_3 is_a: CHEBI:149429 ! xylotriose [Term] id: CHEBI:62785 name: beta-D-Manp-(1->4)-beta-D-Manp-(1->4)-D-Manp subset: chebi_ph7_3 is_a: CHEBI:146181 ! mannotriose [Term] id: CHEBI:62787 name: 1,5-dihydroflavin subset: chebi_ph7_3 is_a: CHEBI:37326 ! benzo[g]pteridine-2,4-dione [Term] id: CHEBI:62788 name: 3-nonaprenyl-4,5-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:62789 name: 3-nonaprenyl-4,5-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:64694 ! 3,4-dihydroxy-5-polyprenylbenzoate [Term] id: CHEBI:62790 name: 3-nonaprenyl-4-hydroxy-5-methoxybenzoic acid is_a: CHEBI:25238 ! methoxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:62791 name: 3-nonaprenyl-4-hydroxy-5-methoxybenzoate subset: chebi_ph7_3 is_a: CHEBI:84443 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate [Term] id: CHEBI:62793 name: 3-decaprenyl-4,5-dihydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:64694 ! 3,4-dihydroxy-5-polyprenylbenzoate [Term] id: CHEBI:62796 name: 3-decaprenyl-4-hydroxy-5-methoxybenzoate subset: chebi_ph7_3 is_a: CHEBI:84443 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate [Term] id: CHEBI:62803 name: fuel additive is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:62804 name: metallochlorin is_a: CHEBI:25216 ! metalloporphyrin [Term] id: CHEBI:62805 name: isooctane subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:48355 ! non-polar solvent relationship: has_role CHEBI:61015 ! nephrotoxin relationship: has_role CHEBI:62803 ! fuel additive [Term] id: CHEBI:62811 name: heme d cis-diol is_a: CHEBI:23824 ! diol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:38573 ! ferroheme is_a: CHEBI:62804 ! metallochlorin relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:62814 name: heme d cis-diol(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:62830 name: dTDP-4-dehydro-beta-L-rhamnose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:62833 name: 1-myristoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:62834 name: 1-linoleoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:62836 name: 2-methylthio-N(6)-(cis-4-hydroxy-Delta(2)-isopentenyl)adenosine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:62837 name: 1-oleoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:62840 name: 1-lauroyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:62845 name: 4-hydroxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62846 name: 4-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:62847 name: 6alpha-hydroxy-17beta-estradiol subset: chebi_ph7_3 is_a: CHEBI:36850 ! 6alpha-hydroxy steroid [Term] id: CHEBI:62857 name: alpha-L-Fucp-(1->2)-D-Galp subset: chebi_ph7_3 is_a: CHEBI:22423 ! alpha-L-fucosyl-(1->2)-D-galactose [Term] id: CHEBI:62858 name: 4,6-Me(COOH)C-beta-D-Man-(1->4)-beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:62860 name: 4,6-Me(COOH)C-beta-D-Man-(1->4)-beta-D-GlcA-(1->2)-alpha-D-Man-(1->3)-beta-D-Glc-(1->4)-alpha-D-Glc-1-diphospho-ditrans,polycis-undecaprenol(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62866 name: 2-methylthio-N(6)-(Delta(2)-isopentenyl)adenosine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:62867 name: soyasaponin III is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:61778 ! triterpenoid saponin relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:62868 ! hepatoprotective agent [Term] id: CHEBI:62868 name: hepatoprotective agent is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:62871 name: EC 4.3.1.24 (phenylalanine ammonia-lyase) inhibitor is_a: CHEBI:76832 ! EC 4.3.1.* (ammonia-lyase) inhibitor [Term] id: CHEBI:62872 name: EC 1.2.3.1 (aldehyde oxidase) inhibitor is_a: CHEBI:76853 ! EC 1.2.3.* (oxidoreductase acting on donor aldehyde/oxo group with oxygen as acceptor) inhibitor [Term] id: CHEBI:62873 name: odorant receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:62875 name: 2-methylthio-N(6)-(Delta(2)-isopentenyl)adenosine subset: chebi_ph7_3 is_a: CHEBI:60783 ! nucleoside analogue [Term] id: CHEBI:62877 name: 2-deoxy-D-ribofuranose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62879 name: 2-methylthio-N(6)-(cis-4-hydroxy-Delta(2)-isopentenyl)adenosine subset: chebi_ph7_3 is_a: CHEBI:60783 ! nucleoside analogue [Term] id: CHEBI:62885 name: adenosine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:62889 name: organic diphosphate is_a: CHEBI:25703 ! organic phosphate [Term] id: CHEBI:62890 name: 2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62894 name: organic triphosphate is_a: CHEBI:25703 ! organic phosphate [Term] id: CHEBI:62898 name: isopentenyl alcohol subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15734 ! primary alcohol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:62899 name: (R,Z)- 2-carboxylato-4-methyl-5-[(2-phosphonatooxy)ethylidene]-2,5-dihydrothiazole(3-) subset: chebi_ph7_3 is_a: CHEBI:58895 ! 2-carboxylato-4-methyl-5-[(2-phosphonatooxy)ethylidene]-2,5-dihydrothiazole(3-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62911 name: soyasaponin III(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62912 name: 2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:38418 ! 1,3-thiazoles [Term] id: CHEBI:62913 name: EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor is_a: CHEBI:76790 ! EC 2.4.2.* (pentosyltransferase) inhibitor [Term] id: CHEBI:62915 name: sialyltransferase inhibitor is_a: CHEBI:76882 ! EC 2.4.99.* (glycosyltransferases transferring other glycosyl groups) inhibitor [Term] id: CHEBI:62916 name: soyasaponin I(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62918 name: 1D-myo-inositol 3,4,6-trisphosphate is_a: CHEBI:25450 ! myo-inositol trisphosphate [Term] id: CHEBI:62919 name: 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate is_a: CHEBI:64604 ! diphosphoinositol polyphosphate [Term] id: CHEBI:62920 name: icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:62921 name: (S,S,S)-nicotianamine monoanion is_a: CHEBI:36299 ! tricarboxylic acid monoanion [Term] id: CHEBI:62922 name: 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate is_a: CHEBI:25447 ! myo-inositol pentakisphosphate [Term] id: CHEBI:62923 name: 1,5-bis(diphospho)-1D-myo-inositol 2,3,4,6-tetrakisphosphate is_a: CHEBI:14178 ! 1D-myo-inositol bis(diphosphate) tetrakisphosphate [Term] id: CHEBI:62924 name: 3,5-bis(diphospho)-1D-myo-inositol 1,2,4,6-tetrakisphosphate is_a: CHEBI:14178 ! 1D-myo-inositol bis(diphosphate) tetrakisphosphate [Term] id: CHEBI:62928 name: 5-diphospho-myo-inositol 1,3,4,6-tetrakisphosphate is_a: CHEBI:25449 ! myo-inositol tetrakisphosphate [Term] id: CHEBI:62932 name: mycophenolate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:62933 name: oxylipin anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:62934 name: discadenine(1-) is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:62936 name: homomethioninate is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:62937 name: icosanoid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:62938 name: hepoxilin anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion [Term] id: CHEBI:62941 name: glycosylceramide is_a: CHEBI:17761 ! ceramide is_a: CHEBI:24402 ! glycosphingolipid [Term] id: CHEBI:62942 name: leukotriene anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:62943 name: prostanoid anion is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:62944 name: sialic acid anion is_a: CHEBI:29067 ! carboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:62945 name: thromboxane anion is_a: CHEBI:62943 ! prostanoid anion [Term] id: CHEBI:62958 name: N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:16511 ! N-acetyl-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol [Term] id: CHEBI:62959 name: N-acetyl-alpha-D-glucosaminyl-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:62974 name: cellotetraose subset: chebi_ph7_3 is_a: CHEBI:147369 ! glucotetraose [Term] id: CHEBI:62976 name: cellopentaose subset: chebi_ph7_3 is_a: CHEBI:35369 ! pentasaccharide [Term] id: CHEBI:62978 name: 4-hydroxyprolinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:62979 name: 5-hydroxylysinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:62980 name: homoserinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:62981 name: 4-hydroxy-L-prolinate is_a: CHEBI:59814 ! L-alpha-amino acid anion is_a: CHEBI:62978 ! 4-hydroxyprolinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:62989 name: chenodeoxycholoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:138842 ! 3alpha-hydroxy bile acid CoA thioester(4-) [Term] id: CHEBI:63001 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:63046 name: emulsifier is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:63047 name: food emulsifier is_a: CHEBI:63046 ! emulsifier is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:63048 name: 1,3-thiazolium cation is_a: CHEBI:25697 ! organic cation is_a: CHEBI:38418 ! 1,3-thiazoles [Term] id: CHEBI:63054 name: osteogenesis regulator is_a: CHEBI:39317 ! growth regulator [Term] id: CHEBI:63056 name: zinc cation is_a: CHEBI:27365 ! zinc ion is_a: CHEBI:33515 ! transition element cation [Term] id: CHEBI:63061 name: UDP-rhamnose is_a: CHEBI:17297 ! UDP-sugar [Term] id: CHEBI:63062 name: aluminium cation is_a: CHEBI:25213 ! metal cation is_a: CHEBI:60272 ! aluminium ion [Term] id: CHEBI:63063 name: cadmium cation is_a: CHEBI:33515 ! transition element cation [Term] id: CHEBI:63065 name: 1,1'-dihydroxy-1,1',2,2'-tetrahydrolycopene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:23824 ! diol is_a: CHEBI:26878 ! tertiary alcohol [Term] id: CHEBI:63067 name: zeaxanthin bis(beta-D-glucoside) subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23044 ! carotenoid [Term] id: CHEBI:63068 name: octacarboxylic acid anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:63069 name: neurosporaxanthin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63070 name: beta-alaninate is_a: CHEBI:49095 ! beta-amino-acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:63072 name: L-homocysteinate is_a: CHEBI:59814 ! L-alpha-amino acid anion is_a: CHEBI:66952 ! homocysteinate [Term] id: CHEBI:631 name: 1-hydroxy-2-aminoethylphosphonic acid is_a: CHEBI:26069 ! phosphonic acids [Term] id: CHEBI:63114 name: sphingosine-1-phosphate receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:63131 name: EDTA(3-) is_a: CHEBI:35754 ! tetracarboxylic acid anion [Term] id: CHEBI:63137 name: 4-hydroxyproline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:63150 name: D-rhamnose is_a: CHEBI:26546 ! rhamnose [Term] id: CHEBI:63151 name: D-rhamnopyranose subset: chebi_ph7_3 is_a: CHEBI:63150 ! D-rhamnose [Term] id: CHEBI:63156 name: EC 1.1.3.13 (alcohol oxidase) inhibitor is_a: CHEBI:76836 ! EC 1.1.3.* (oxidoreductase acting on donor CH-OH group, oxygen as acceptor) inhibitor [Term] id: CHEBI:63157 name: EC 4.2.1.22 (cystathionine beta-synthase) inhibitor is_a: CHEBI:76907 ! EC 4.2.1.* (hydro-lyases) inhibitor [Term] id: CHEBI:63158 name: EC 2.3.1.21 (carnitine O-palmitoyltransferase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:63161 name: glycosyl compound is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63163 name: L-cystine anion is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:63164 name: prosolanapyrone III subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:38237 ! prosolanapyrone [Term] id: CHEBI:63165 name: ribonucleoside monophosphate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63166 name: leukotriene D4(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:63167 name: raucaffrinoline subset: chebi_ph7_3 is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:63168 name: perakine subset: chebi_ph7_3 is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:63169 name: pyranopterin is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:63171 name: mononitrotoluene is_a: CHEBI:25566 ! nitrotoluene [Term] id: CHEBI:63173 name: T-cell proliferation inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:63177 name: 11alpha-hydroxy-beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:63178 name: (13R)-edaxadiene subset: chebi_ph7_3 is_a: CHEBI:59685 ! edaxadiene [Term] id: CHEBI:63180 name: (13S)-edaxadiene subset: chebi_ph7_3 is_a: CHEBI:59685 ! edaxadiene [Term] id: CHEBI:63184 name: 11-oxo-beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:63190 name: (+)-beta-caryophyllene subset: chebi_ph7_3 is_a: CHEBI:63191 ! beta-caryophyllene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63191 name: beta-caryophyllene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon [Term] id: CHEBI:63194 name: D-ravidosamine is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:63196 name: (+)-caryolan-1-ol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:63202 name: dTDP-D-ravidosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:63203 name: (-)-gamma-cadinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:180496 ! gamma-cadinene is_a: CHEBI:22976 ! cadinene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63205 name: (+)-gamma-cadinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:180496 ! gamma-cadinene is_a: CHEBI:22976 ! cadinene [Term] id: CHEBI:63207 name: mycinamicin III is_a: CHEBI:63276 ! mycinamicin [Term] id: CHEBI:63208 name: 2-hydroxy-dATP is_a: CHEBI:37042 ! purine 2'-deoxyribonucleoside 5'-triphosphate [Term] id: CHEBI:63209 name: 2-hydroxy-dATP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:63211 name: 2-hydroxy-dAMP is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:63212 name: 2-hydroxy-dAMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63216 name: 5(S),8(R)-DiHODE is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:36326 ! octadecanoid [Term] id: CHEBI:63217 name: 5(S),8(R)-DiHODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63220 name: 8-oxo-dGTP is_a: CHEBI:37042 ! purine 2'-deoxyribonucleoside 5'-triphosphate relationship: has_role CHEBI:25435 ! mutagen [Term] id: CHEBI:63222 name: 8-oxo-dGTP(3-) is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:63223 name: 8-oxo-dGMP is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:63224 name: 8-oxo-dGMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63237 name: (9R,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid is_a: CHEBI:63238 ! (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid [Term] id: CHEBI:63238 name: (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:63239 name: (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:63241 name: (9R,10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:63239 ! (10E,12Z,15Z)-9-hydroperoxyoctadeca-10,12,15-trienoate [Term] id: CHEBI:63243 name: pentalen-13-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:63244 name: pentalen-13-al subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:63245 name: 3-hydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione subset: chebi_ph7_3 is_a: CHEBI:26616 ! seco-androstane is_a: CHEBI:33853 ! phenols is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:63247 name: reducing agent is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:63248 name: oxidising agent is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:63249 name: (Z)-2-methylureidoperacrylic acid subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas is_a: CHEBI:52094 ! peroxy acid [Term] id: CHEBI:63250 name: (Z)-2-methyl-3-aminoperacrylic acid subset: chebi_ph7_3 is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:52094 ! peroxy acid [Term] id: CHEBI:63251 name: 2-oxepin-2(3H)-ylideneacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:63252 name: 2-oxepin-2(3H)-ylideneacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:63253 name: 3-oxo-5,6-dehydrosuberyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:63255 name: 3-oxo-5,6-dehydrosuberyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:63256 name: 3,8-dioxooct-5-enoyl-CoA is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:63257 name: 3,8-dioxooct-5-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:63260 name: dTDP-alpha-D-desosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63262 name: dTDP-3-azaniumyl-3,4,6-trideoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63263 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GalpNAc(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63264 name: dTDP-3-amino-3,6-dideoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:63265 name: dTDP-3-azaniumyl-3,6-dideoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63266 name: 4-deoxy-Delta(4)-beta-D-GlcpA-(1->3)-beta-D-GalpNAc6S is_a: CHEBI:16735 ! 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronic acid)-6-O-sulfo-D-glucopyranose is_a: CHEBI:22160 ! acetamides is_a: CHEBI:37909 ! oligosaccharide sulfate [Term] id: CHEBI:63267 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GalpNAc6S(2-) subset: chebi_ph7_3 is_a: CHEBI:57878 ! 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronate)-6-O-sulfonato-D-galactopyranose(2-) [Term] id: CHEBI:63268 name: dTDP-alpha-D-mycaminose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63269 name: dTDP-3-dehydro-6-deoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63270 name: N-acetyl-beta-D-galactosamine 6-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:63271 name: 4-deoxy-Delta(4)-beta-D-GlcpA2S-(1->3)-beta-D-GalpNAc is_a: CHEBI:37909 ! oligosaccharide sulfate [Term] id: CHEBI:63273 name: UDP-2-acetamido-4-amino-2,4,6-trideoxy-alpha-D-glucose is_a: CHEBI:16549 ! UDP-2-acetamido-4-amino-2,4,6-trideoxy-D-glucose [Term] id: CHEBI:63274 name: 4-deoxy-Delta(4)-beta-D-GlcpA2S-(1->3)-beta-D-GalpNAc(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63275 name: 5-dehydro-4-deoxy-2-O-sulfo-D-glucuronic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35724 ! carbohydrate sulfate [Term] id: CHEBI:63276 name: mycinamicin is_a: CHEBI:25105 ! macrolide antibiotic relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:63277 name: UDP-2-acetamido-4-azaniumyl-2,4,6-trideoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63278 name: 5-dehydro-4-deoxy-2-O-sulfo-D-glucuronic acid(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63280 name: beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GlcpNAc(1-) subset: chebi_ph7_3 is_a: CHEBI:132151 ! beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-D-GlcpNAc(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63281 name: pseudaminic acid is_a: CHEBI:63394 ! ketoaldonic acid derivative [Term] id: CHEBI:63282 name: pseudaminate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63283 name: 2,4-diacetamido-2,4,6-trideoxy-beta-L-altrose subset: chebi_ph7_3 is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63349 ! trideoxyhexose derivative [Term] id: CHEBI:63284 name: mycinamicin IV is_a: CHEBI:63276 ! mycinamicin [Term] id: CHEBI:63285 name: mycinamicin VI is_a: CHEBI:63276 ! mycinamicin [Term] id: CHEBI:63286 name: dTDP-3-amino-3,6-dideoxy-alpha-D-galactopyranose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:63287 name: 3-amino-3,6-dideoxy-alpha-D-galactopyranose is_a: CHEBI:24586 ! hexosamine [Term] id: CHEBI:63299 name: carbohydrate derivative is_a: CHEBI:78616 ! carbohydrates and carbohydrate derivatives [Term] id: CHEBI:63300 name: osmoregulated periplasmic glucan is_a: CHEBI:37163 ! glucan [Term] id: CHEBI:63302 name: dTDP-3-dehydro-6-deoxy-alpha-D-galactose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone [Term] id: CHEBI:63303 name: dTDP-3-dehydro-6-deoxy-alpha-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63304 name: dTDP-D-ravidosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63305 name: dTDP-3-amino-3,6-dideoxy-alpha-D-galactopyranose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63307 name: 10-deoxymethymycin(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:63308 name: mycinamicin III(1+) subset: chebi_ph7_3 is_a: CHEBI:63309 ! mycinamicin cation [Term] id: CHEBI:63309 name: mycinamicin cation is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:6331 name: erythro-4-hydroxy-L-glutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:63310 name: mycinamicin IV(1+) subset: chebi_ph7_3 is_a: CHEBI:63309 ! mycinamicin cation [Term] id: CHEBI:63311 name: mycinamicin VI(1+) subset: chebi_ph7_3 is_a: CHEBI:63309 ! mycinamicin cation [Term] id: CHEBI:63319 name: D-erythritol 1-phosphate is_a: CHEBI:22292 ! alditol 1-phosphate [Term] id: CHEBI:63322 name: (S)-2-hydroxy-3-oxo-4-(phosphonooxy)butanoic acid is_a: CHEBI:24962 ! ketoaldonic acid phosphate [Term] id: CHEBI:63323 name: 9(R)-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) is_a: CHEBI:146293 ! 9-HPODE(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63324 name: (8E,10R,12Z)-10-hydroperoxy-8,12-octadecadienoate subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) [Term] id: CHEBI:63325 name: (2R,3S)-2,4',7-trihydroxyisoflavanone subset: chebi_ph7_3 is_a: CHEBI:72739 ! hydroxyisoflavanone [Term] id: CHEBI:63328 name: 4'-hydroxyisoflavones subset: chebi_ph7_3 is_a: CHEBI:38755 ! hydroxyisoflavone [Term] id: CHEBI:63330 name: sodium-dependent Pi-transporter inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:63331 name: 9(R)-HPODE is_a: CHEBI:36329 ! HPODE [Term] id: CHEBI:63332 name: EC 3.1.3.1 (alkaline phosphatase) inhibitor is_a: CHEBI:76775 ! EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor [Term] id: CHEBI:63338 name: deoxy sugar derivative is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63339 name: deoxy oligosaccharide derivative is_a: CHEBI:63338 ! deoxy sugar derivative [Term] id: CHEBI:63340 name: deoxyhexose derivative is_a: CHEBI:63338 ! deoxy sugar derivative [Term] id: CHEBI:63346 name: deoxymannose derivative is_a: CHEBI:63340 ! deoxyhexose derivative [Term] id: CHEBI:63347 name: dideoxyhexose derivative is_a: CHEBI:63340 ! deoxyhexose derivative [Term] id: CHEBI:63349 name: trideoxyhexose derivative is_a: CHEBI:63340 ! deoxyhexose derivative [Term] id: CHEBI:63350 name: deoxyketohexose derivative is_a: CHEBI:63340 ! deoxyhexose derivative [Term] id: CHEBI:63351 name: deoxyketopentose derivative is_a: CHEBI:63355 ! deoxypentose derivative [Term] id: CHEBI:63352 name: deoxyaldohexose derivative is_a: CHEBI:63340 ! deoxyhexose derivative [Term] id: CHEBI:63353 name: disaccharide derivative is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63355 name: deoxypentose derivative is_a: CHEBI:63338 ! deoxy sugar derivative [Term] id: CHEBI:63360 name: glycosylgalactose derivative is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:63361 name: glycosylglucose derivative is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:63367 name: monosaccharide derivative is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63368 name: aldose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63369 name: D-aldose derivative is_a: CHEBI:63368 ! aldose derivative [Term] id: CHEBI:63373 name: aldopentose derivative is_a: CHEBI:63368 ! aldose derivative is_a: CHEBI:63409 ! pentose derivative [Term] id: CHEBI:63378 name: anhydro sugar derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63379 name: anhydrohexose derivative is_a: CHEBI:63378 ! anhydro sugar derivative [Term] id: CHEBI:63383 name: heptose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63384 name: ketoheptose derivative is_a: CHEBI:63383 ! heptose derivative [Term] id: CHEBI:63385 name: hexose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63389 name: UDP-4-amino-4,6-dideoxy-L-N-acetyl-beta-L-altrosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:63391 name: ketohexose derivative is_a: CHEBI:63385 ! hexose derivative [Term] id: CHEBI:63394 name: ketoaldonic acid derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63401 name: ketooctose derivative is_a: CHEBI:63402 ! ketose derivative [Term] id: CHEBI:63402 name: ketose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63403 name: sedoheptulose derivative is_a: CHEBI:63384 ! ketoheptose derivative [Term] id: CHEBI:63405 name: ketopentose derivative is_a: CHEBI:63402 ! ketose derivative is_a: CHEBI:63409 ! pentose derivative [Term] id: CHEBI:63407 name: ketotriose derivative is_a: CHEBI:63402 ! ketose derivative is_a: CHEBI:63413 ! triose derivative [Term] id: CHEBI:63409 name: pentose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63410 name: all-trans-retinyl ester subset: chebi_ph7_3 is_a: CHEBI:12777 ! vitamin A is_a: CHEBI:16179 ! retinyl ester [Term] id: CHEBI:63413 name: triose derivative is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:63415 name: glycodiaosylceramide is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:63416 name: 4-amino-5-ammoniomethyl-2-methylpyrimidine subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:63417 name: UDP-2,4-diacetamido-2,4,6-trideoxy-beta-L-altrose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63420 name: UDP-4-amino-4,6-dideoxy-L-N-acetyl-beta-L-altrosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:63421 name: beta-L-altrose subset: chebi_ph7_3 is_a: CHEBI:149543 ! L-altrose relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:63422 name: UDP-2,4-diacetamido-2,4,6-trideoxy-beta-L-altrose is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:63423 name: alditol derivative is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63424 name: glycosyl alditol derivative is_a: CHEBI:63423 ! alditol derivative [Term] id: CHEBI:63425 name: galactosylglycerol derivative is_a: CHEBI:63424 ! glycosyl alditol derivative is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63426 name: glucosylglycerol derivative is_a: CHEBI:63424 ! glycosyl alditol derivative is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63427 name: glycosylglycerol derivative is_a: CHEBI:63424 ! glycosyl alditol derivative [Term] id: CHEBI:63428 name: digalactosylglycerol derivative is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63430 name: hexitol derivative is_a: CHEBI:63423 ! alditol derivative [Term] id: CHEBI:63432 name: galactitol derivative is_a: CHEBI:63430 ! hexitol derivative [Term] id: CHEBI:63434 name: pentitol derivative is_a: CHEBI:63423 ! alditol derivative [Term] id: CHEBI:63435 name: tetritol derivative is_a: CHEBI:63423 ! alditol derivative [Term] id: CHEBI:63436 name: carbohydrate acid derivative is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63437 name: aldaric acid derivative is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:63438 name: hexaric acid derivative is_a: CHEBI:63437 ! aldaric acid derivative [Term] id: CHEBI:63441 name: aldonic acid derivative is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:63442 name: hexonic acid derivative is_a: CHEBI:63441 ! aldonic acid derivative [Term] id: CHEBI:63443 name: alpha-guaiene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63444 name: viridiflorene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:63445 name: 5-epi-alpha-selinene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:49272 ! selinene relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:63446 name: (-)-cubebol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:63447 name: delta-guaiene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63454 name: pentonic acid derivative is_a: CHEBI:63441 ! aldonic acid derivative [Term] id: CHEBI:63455 name: tetronic acid derivative is_a: CHEBI:63441 ! aldonic acid derivative [Term] id: CHEBI:63458 name: 2-(1,2-epoxy-1,2-dihydrophenyl)acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:63459 name: shionone subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:63460 name: parkeol subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63461 name: achilleol B subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:52340 ! tricyclic triterpenoid [Term] id: CHEBI:63462 name: glutinol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:63463 name: baccharis oxide subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:63464 name: alpha-seco-amyrin subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:63465 name: marneral subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:63466 name: beta-seco-amyrin subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid [Term] id: CHEBI:63467 name: delta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:63468 name: tirucalla-7,24-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:83211 ! tirucallane triterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63469 name: 3-hydroxy-3-phenylpropionate subset: chebi_ph7_3 is_a: CHEBI:22743 ! benzyl alcohols is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63470 name: sulfur-containing amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:63471 name: branched-chain amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:63473 name: aromatic amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:63474 name: arsonoacetic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63475 name: ectoinate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63476 name: 4-carboxylato-4'-sulfonatoazobenzene subset: chebi_ph7_3 is_a: CHEBI:22682 ! azobenzenes is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:53348 ! benzenesulfonates [Term] id: CHEBI:63477 name: iodothyroninate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:63488 name: beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAcl-(1->4)-beta-D-GlcNAc-yl group subset: chebi_ph7_3 is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:63490 name: explosive is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:63510 name: EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor is_a: CHEBI:76895 ! EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor [Term] id: CHEBI:63523 name: fructosyllysinate is_a: CHEBI:63790 ! glyco-amino-acid anion [Term] id: CHEBI:63524 name: 5-hydroxyectoinate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63525 name: D-mannosyl-D-glycerate is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:63526 name: platinum cation is_a: CHEBI:33515 ! transition element cation is_a: CHEBI:49202 ! elemental platinum [Term] id: CHEBI:63527 name: TTP(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63528 name: dTMP(2-) subset: chebi_ph7_3 is_a: CHEBI:142209 ! pyrimidine 2'-deoxyribonucleoside 5'-phosphate(2-) is_a: CHEBI:65317 ! 2'-deoxynucleoside 5'-monophosphate(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:63529 name: guanyl deoxyribonucleotide oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63534 name: monoamine is_a: CHEBI:64365 ! aralkylamino compound [Term] id: CHEBI:63539 name: (5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:76189 ! timnodonoyl bioconjugate [Term] id: CHEBI:63540 name: (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63541 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:63542 name: (8Z,11Z,14Z,17Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:63543 name: (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:63544 name: (7Z,10Z,13Z,16Z)-docosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:63545 name: (6Z,9Z,12Z,15Z)-octadecatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:76185 ! stearidonoyl bioconjugate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63546 name: (6Z,9Z,12Z,15Z,18Z)-tetracosapentaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63547 name: 2-(1,2-epoxy-1,2-dihydrophenyl)acetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:63548 name: (9Z,12Z,15Z,18Z)-tetracosatetraenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:63550 name: TTP is_a: CHEBI:37044 ! pyrimidine ribonucleoside 5'-triphosphate [Term] id: CHEBI:63551 name: carbohydrate acid derivative anion is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:63552 name: 1-phenyl-1,2-propanedione subset: chebi_ph7_3 is_a: CHEBI:51869 ! alpha-diketone is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63553 name: 2-hydroxy-1-phenyl-1-propanone subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:63558 name: DIBOA subset: chebi_ph7_3 is_a: CHEBI:23445 ! cyclic hydroxamic acid is_a: CHEBI:38131 ! lactol is_a: CHEBI:46969 ! benzoxazine relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:38231 ! phytotoxin relationship: has_role CHEBI:62215 ! allelochemical relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63559 name: HBOA subset: chebi_ph7_3 is_a: CHEBI:24995 ! lactam is_a: CHEBI:38131 ! lactol is_a: CHEBI:46969 ! benzoxazine relationship: has_role CHEBI:62215 ! allelochemical relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63561 name: ketoaldonate derivative is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:63563 name: oligosaccharide derivative is_a: CHEBI:167559 ! glycan is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:63566 name: pentasaccharide derivative is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:63567 name: tetrasaccharide derivative is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:63571 name: trisaccharide derivative is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:63573 name: guanyl deoxyribonucleotide is_a: CHEBI:26390 ! purine 2'-deoxyribonucleotide is_a: CHEBI:61292 ! guanyl nucleotide [Term] id: CHEBI:63576 name: maltose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63579 name: 18-HETE is_a: CHEBI:36275 ! HETE [Term] id: CHEBI:63580 name: ribavirin subset: chebi_ph7_3 is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:62733 ! aromatic amide is_a: CHEBI:63594 ! 1-ribosyltriazole relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:59897 ! EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor [Term] id: CHEBI:63582 name: 1-palmitoylglycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:63590 name: 18-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:63592 name: maltose 1-phosphate is_a: CHEBI:25143 ! maltose phosphate [Term] id: CHEBI:63593 name: 1-glycosyltriazole is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35727 ! triazoles [Term] id: CHEBI:63594 name: 1-ribosyltriazole is_a: CHEBI:63593 ! 1-glycosyltriazole [Term] id: CHEBI:63606 name: (6S)-5-formyltetrahydrofolic acid is_a: CHEBI:15640 ! 5-formyltetrahydrofolic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:63618 name: pravastatin is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid is_a: CHEBI:87633 ! statin (semi-synthetic) relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:35821 ! anticholesteremic drug relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:63624 name: telbivudine subset: chebi_ph7_3 is_a: CHEBI:19255 ! pyrimidine 2'-deoxyribonucleoside relationship: has_role CHEBI:36044 ! antiviral drug relationship: has_role CHEBI:59897 ! EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor [Term] id: CHEBI:63640 name: 26-hydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:63641 name: 9alpha-hydroxyandrosta-1,4-diene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:63644 ! 9-hydroxy steroid is_a: CHEBI:77166 ! 3-oxo-Delta(1),Delta(4)-steroid [Term] id: CHEBI:63644 name: 9-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:63655 name: (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6,8-dihydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid [Term] id: CHEBI:63656 name: 9beta-pimara-7,15-dien-19-ol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:49192 ! pimarane diterpenoid [Term] id: CHEBI:63658 name: 9beta-pimara-7,15-dien-19-al subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:49192 ! pimarane diterpenoid [Term] id: CHEBI:63659 name: 9beta-pimara-7,15-dien-19-oate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63660 name: pravastatin(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63662 name: 11alpha-hydroxy-ent-cassa-12,15-diene subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:63663 name: 10beta,14beta-dihydroxytaxa-4(20),11-dien-5alpha-yl acetate subset: chebi_ph7_3 is_a: CHEBI:50367 ! taxane diterpenoid [Term] id: CHEBI:63664 name: taxusin subset: chebi_ph7_3 is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63665 name: 7beta-hydroxytaxusin subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63668 name: abieta-7,13-dien-18,18-diol subset: chebi_ph7_3 is_a: CHEBI:63733 ! aldehyde hydrate [Term] id: CHEBI:63670 name: DIBOA beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:63671 name: TRIBOA beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:23445 ! cyclic hydroxamic acid is_a: CHEBI:46969 ! benzoxazine [Term] id: CHEBI:63672 name: 3-methoxy-4',5-dihydroxy-trans-stilbene subset: chebi_ph7_3 is_a: CHEBI:36027 ! stilbenol [Term] id: CHEBI:63676 name: dTDP-3-acetamido-3,6-dideoxy-alpha-D-galactopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63677 name: erythromycin D(1+) subset: chebi_ph7_3 is_a: CHEBI:64290 ! erythromycin cation [Term] id: CHEBI:63679 name: [4)-beta-D-GlcA-(1->4)-beta-D-GlcA2(or 3)Ac-(1->4)-beta-D-Glc-(1->4)-[(R)-4,6-CH3(COO(-))C-beta-D-Gal3(or 2)OHb-(1->3)-(S)-4,6-CH3(COO(-))C-beta-D-Glc-(1->4)-beta-D-Glc-(1->4)-beta-D-Glc-(1->6)]-alpha-DGlc2(or 3)Ac-(1->]n subset: chebi_ph7_3 is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:63680 name: CMP-pseudaminate subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:63682 name: (5S,9S,10S,13E)-labda-7,13-dien-15-yl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63683 name: (13E)-labda-7,13-dien-15-ol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36770 ! labdane diterpenoid [Term] id: CHEBI:63689 name: P(1),P(6)-bis(5'-adenosyl)hexaphosphate is_a: CHEBI:63736 ! diadenosyl hexaphosphate relationship: has_role CHEBI:50514 ! vasoconstrictor agent [Term] id: CHEBI:63690 name: (1E,2Z)-3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate subset: chebi_ph7_3 is_a: CHEBI:58607 ! 3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate [Term] id: CHEBI:63692 name: 9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:63693 name: (2Z,4Z)-2-hydroxyhexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63694 name: D-synephrine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:63696 name: gamma-curcumene subset: chebi_ph7_3 is_a: CHEBI:33654 ! alicyclic compound is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63701 name: (-)-alpha-cuprenene subset: chebi_ph7_3 is_a: CHEBI:33654 ! alicyclic compound is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63702 name: avermitilol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:63703 name: (-)-delta-cadinene subset: chebi_ph7_3 is_a: CHEBI:140564 ! delta-cadinene is_a: CHEBI:22976 ! cadinene [Term] id: CHEBI:63704 name: (+)-Tau-muurolol subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:22975 ! cadinane sesquiterpenoid [Term] id: CHEBI:63707 name: syn-labda-8(17),12E,14-triene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:63708 name: isopimara-8(14),15-diene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63709 name: bicyclogermacrene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63710 name: 7-epi-sesquithujene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63711 name: sesquithujene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63712 name: baruol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63714 name: 7-methylguanosine 5'-diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63715 name: 8-oxo-dGDP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63726 name: neuroprotective agent is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:63727 name: cis-4-hydroxy-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:63728 name: 8-oxo-dGDP is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate [Term] id: CHEBI:63729 name: 7-methylguanosine 5'-diphosphate is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:63730 name: 7-methylguanosine 5'-diphosphate(1+) is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:63731 name: 9beta-pimara-7,15-dien-19-oic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:49192 ! pimarane diterpenoid [Term] id: CHEBI:63732 name: 1,1-diol is_a: CHEBI:30879 ! alcohol [Term] id: CHEBI:63733 name: aldehyde hydrate subset: chebi_ph7_3 is_a: CHEBI:63732 ! 1,1-diol [Term] id: CHEBI:63734 name: ketone hydrate subset: chebi_ph7_3 is_a: CHEBI:63732 ! 1,1-diol [Term] id: CHEBI:63735 name: (2Z,4Z)-2-hydroxyhexa-2,4-dienoic acid is_a: CHEBI:33823 ! enol is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:63736 name: diadenosyl hexaphosphate is_a: CHEBI:64603 ! diadenosyl polyphosphate [Term] id: CHEBI:63737 name: diadenosyl pentaphosphate is_a: CHEBI:64603 ! diadenosyl polyphosphate [Term] id: CHEBI:63738 name: diadenosyl tetraphosphate is_a: CHEBI:64603 ! diadenosyl polyphosphate [Term] id: CHEBI:63739 name: diadenosyl triphosphate is_a: CHEBI:64603 ! diadenosyl polyphosphate [Term] id: CHEBI:63740 name: P(1),P(6)-bis(5'-adenosyl)hexaphosphate(6-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63741 name: 9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:46640 ! diketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:63742 name: (1E,2Z)-3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oic acid is_a: CHEBI:29086 ! 3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oic acid [Term] id: CHEBI:63743 name: dTDP-3-acetamido-3,6-dideoxy-alpha-D-galactopyranose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:63746 name: TRIBOA subset: chebi_ph7_3 is_a: CHEBI:23445 ! cyclic hydroxamic acid is_a: CHEBI:38131 ! lactol is_a: CHEBI:46969 ! benzoxazine [Term] id: CHEBI:63749 name: (+)-artemisinic acid is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63750 name: (5S,9S,10S,13E)-labda-7,13-dien-15-yl diphosphate is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:63775 name: 1,2-dioleoyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol is_a: CHEBI:63887 ! 1,2-dioleoyl-3-beta-D-galactosylglycerol [Term] id: CHEBI:63778 name: CMP-pseudaminic acid is_a: CHEBI:20878 ! CMP-sugar [Term] id: CHEBI:63779 name: alpha-D-Gal-(1->2)-alpha-D-Glc-(1->3')-1,2-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63786 name: beta-D-Glc-(1->6)-beta-D-Glc-(1->3')-1,2-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63788 name: alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3')-1,2-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:63790 name: glyco-amino-acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:63794 name: retinoid X receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:63795 name: all-trans-4-hydroxyretinoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:63796 name: N(alpha)-citryl-N(epsilon)-acetyl-N(epsilon)-hydroxylysine(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:63801 name: N(alpha)-citryl-N(epsilon)-acetyl-N(epsilon)-hydroxylysine is_a: CHEBI:25095 ! L-lysine derivative [Term] id: CHEBI:63803 name: (E)-2,3-didehydropristanoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:63813 name: adenosine 5'-pentaphosphate(6-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:63818 name: 1-hexadecyl-sn-glycerol 3-phosphate is_a: CHEBI:17106 ! 1-alkyl-sn-glycerol 3-phosphate [Term] id: CHEBI:63821 name: (7Z,10Z,13Z,16Z)-3-oxodocosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:63823 name: 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:63837 name: pregn-5-ene-3,20-dione subset: chebi_ph7_3 is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47907 ! 3-oxo-Delta(5)-steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:63838 name: (24S)-7alpha,24-dihydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:48701 ! 7alpha,24-dihydroxycholest-4-en-3-one [Term] id: CHEBI:63844 name: 4-carboxyzymosterol is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:63856 name: 4,8-dimethylnonanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:63862 name: 3'-N-debenzoyltaxol is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63863 name: 3'-N-debenzoyltaxol(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:63864 name: 4,8-dimethylnonanoic acid is_a: CHEBI:35819 ! branched-chain fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:63867 name: N-(hexanoyl)sphing-4-enine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:63887 name: 1,2-dioleoyl-3-beta-D-galactosylglycerol subset: chebi_ph7_3 is_a: CHEBI:61799 ! beta-D-galactopyranosyl diglyceride [Term] id: CHEBI:63891 name: 3-oxopristanic acid is_a: CHEBI:134416 ! 3-oxo fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:63892 name: zerumbone subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:140922 ! glioma-associated oncogene inhibitor relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:63893 name: 8-hydroxy-alpha-humulene subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:63894 name: pivalate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:63900 name: 3,16-dihydroxyhexadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:63902 name: (+)-thujan-3-ol subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:50041 ! thujane monoterpenoid [Term] id: CHEBI:63904 name: 3,16-dihydroxyhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:63906 name: cholest-5-en-3-one subset: chebi_ph7_3 is_a: CHEBI:47907 ! 3-oxo-Delta(5)-steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63912 name: 19-hydroxyprostaglandin H2 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:63931 name: L-erythro-biopterin subset: chebi_ph7_3 is_a: CHEBI:15373 ! biopterin [Term] id: CHEBI:63932 name: EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor is_a: CHEBI:76847 ! EC 1.14.16.* (oxidoreductase acting on paired donors, reduced pteridine as one donor, incorporating 1 atom of oxygen) inhibitor [Term] id: CHEBI:63933 name: Aroclor 1254 subset: chebi_ph7_3 is_a: CHEBI:60004 ! mixture relationship: has_part CHEBI:53156 ! polychlorobiphenyl relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:63944 name: macrocyclic lactone is_a: CHEBI:25000 ! lactone is_a: CHEBI:51026 ! macrocycle [Term] id: CHEBI:63947 name: 2,2'-disulfoazobenzene is_a: CHEBI:22682 ! azobenzenes is_a: CHEBI:33555 ! arenesulfonic acid [Term] id: CHEBI:63950 name: 2,2'-disulfonatoazobenzene subset: chebi_ph7_3 is_a: CHEBI:22713 ! arenesulfonate oxoanion [Term] id: CHEBI:63951 name: estrogen receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:63953 name: 2-amino-6-chloro-4-(3-sulfoanilino)-1,3,5-triazine is_a: CHEBI:33555 ! arenesulfonic acid is_a: CHEBI:38170 ! diamino-1,3,5-triazine [Term] id: CHEBI:63954 name: ionomycin is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:33823 ! enol is_a: CHEBI:37407 ! cyclic ether relationship: has_role CHEBI:22986 ! calcium ionophore relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63955 name: 2-amino-6-chloro-4-(3-sulfonatoanilino)-1,3,5-triazine subset: chebi_ph7_3 is_a: CHEBI:22713 ! arenesulfonate oxoanion is_a: CHEBI:38170 ! diamino-1,3,5-triazine [Term] id: CHEBI:63962 name: Hsp90 inhibitor is_a: CHEBI:76939 ! EC 3.6.4.10 (non-chaperonin molecular chaperone ATPase) inhibitor [Term] id: CHEBI:63966 name: (5Z,8Z,11Z)-14,15-dihydroxyicosatrienoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:23824 ! diol is_a: CHEBI:64005 ! DHET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63969 name: (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoic acid is_a: CHEBI:64005 ! DHET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63970 name: (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:23824 ! diol is_a: CHEBI:64005 ! DHET relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:63976 name: 13,14-dihydro-15-keto-PGF2alpha is_a: CHEBI:17087 ! ketone is_a: CHEBI:36066 ! prostaglandins Falpha relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63977 name: 12S-HHTrE is_a: CHEBI:72783 ! 12-HHTrE [Term] id: CHEBI:63979 name: 20-oxoleukotriene B4 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:50413 ! hydroxyaldehyde is_a: CHEBI:76328 ! omega-oxo fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63981 name: 6-trans-leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:63982 name: Delta(6)-trans-12-epi-leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:63983 name: eoxin A4 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:193574 ! eoxin is_a: CHEBI:25029 ! leukotriene is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:63989 name: 15(R)-HETE is_a: CHEBI:64017 ! (5Z,8Z,11Z,13E)-15-HETE [Term] id: CHEBI:63992 name: 15-oxolipoxin A4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59644 ! oxo fatty acid is_a: CHEBI:6497 ! lipoxin [Term] id: CHEBI:63993 name: 13,14-dihydro-15-oxolipoxin A4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:59644 ! oxo fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:63994 name: 16-HETE is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:36275 ! HETE [Term] id: CHEBI:63995 name: 17-HETE is_a: CHEBI:36275 ! HETE [Term] id: CHEBI:63998 name: 19-HETE is_a: CHEBI:36275 ! HETE [Term] id: CHEBI:64005 name: DHET is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64006 name: (8E,10R,12Z)-10-hydroperoxy-8,12-octadecadienoic acid is_a: CHEBI:64008 ! (8E,12Z)-10-hydroperoxy-8,12-octadecadienoic acid [Term] id: CHEBI:64007 name: EET is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:61498 ! epoxy fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor [Term] id: CHEBI:64008 name: (8E,12Z)-10-hydroperoxy-8,12-octadecadienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid [Term] id: CHEBI:64009 name: hydroperoxy fatty acid is_a: CHEBI:35366 ! fatty acid is_a: CHEBI:61051 ! lipid hydroperoxide [Term] id: CHEBI:64011 name: (3Z)-2-oxohex-3-enedioate subset: chebi_ph7_3 is_a: CHEBI:64928 ! 2-oxohex-3-enedioate [Term] id: CHEBI:64012 name: hydroperoxy fatty acid anion is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:64014 name: (5Z,8Z,10E,12E)-icosatetraenoic acid is_a: CHEBI:36033 ! icosatetraenoic acid [Term] id: CHEBI:64016 name: (2E,4Z)-2-hydroxymuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:64017 name: (5Z,8Z,11Z,13E)-15-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:64018 name: protein kinase C agonist is_a: CHEBI:64106 ! protein kinase agonist [Term] id: CHEBI:64023 name: 1-palmitoylglycerol 3-phosphate is_a: CHEBI:76629 ! 2-lysophosphatidic acid [Term] id: CHEBI:64024 name: beta-D-GlcpA-(1->3)-D-GlcpNAc is_a: CHEBI:22480 ! amino disaccharide [Term] id: CHEBI:64031 name: (3E)-2-oxohex-3-enedioic acid is_a: CHEBI:64927 ! 2-oxohex-3-enedioic acid [Term] id: CHEBI:64032 name: linoleoyl ethanolamide subset: chebi_ph7_3 is_a: CHEBI:134159 ! N-acylethanolamine 18:2 relationship: has_role CHEBI:64033 ! EC 3.5.1.99 (fatty acid amide hydrolase) inhibitor [Term] id: CHEBI:64033 name: EC 3.5.1.99 (fatty acid amide hydrolase) inhibitor is_a: CHEBI:76807 ! EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor [Term] id: CHEBI:64037 name: (2E,4Z)-2-hydroxymuconic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:24553 ! hexadienedioic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid [Term] id: CHEBI:64038 name: (3Z)-2-oxohex-3-enedioic acid is_a: CHEBI:64927 ! 2-oxohex-3-enedioic acid [Term] id: CHEBI:64039 name: (2S)-pristanoyl-CoA is_a: CHEBI:51341 ! pristanoyl-CoA [Term] id: CHEBI:64047 name: food additive is_a: CHEBI:33232 ! application is_a: CHEBI:78295 ! food component [Term] id: CHEBI:64049 name: food acidity regulator is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:64054 name: delta-opioid receptor agonist is_a: CHEBI:60601 ! delta-opioid agent is_a: CHEBI:60606 ! opioid receptor agonist [Term] id: CHEBI:64074 name: (S)-NADHX(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:64075 name: (R)-NADHX(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:64076 name: (S)-NADPHX(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:64077 name: (R)-NADPHX(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:64084 name: (S)-NADPHX is_a: CHEBI:26916 ! tetrahydronicotinamide adenine dinucleotide is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:64085 name: (R)-NADPHX is_a: CHEBI:26916 ! tetrahydronicotinamide adenine dinucleotide is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:64090 name: tert-butyl hydroperoxide subset: chebi_ph7_3 is_a: CHEBI:61050 ! alkyl hydroperoxide relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:63248 ! oxidising agent [Term] id: CHEBI:64106 name: protein kinase agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:64120 name: M-factor is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:25676 ! oligopeptide is_a: CHEBI:38579 ! peptide pheromone [Term] id: CHEBI:64121 name: P-factor is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:25905 ! peptide hormone is_a: CHEBI:33694 ! biomacromolecule [Term] id: CHEBI:64124 name: phytosphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:64130 name: pyrazinoindole is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:64133 name: EC 2.5.1.58 (protein farnesyltransferase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:64136 name: 4-hydroxy-3-all-trans-decaprenylbenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:64152 name: cysteine protease inhibitor is_a: CHEBI:37670 ! protease inhibitor is_a: CHEBI:76796 ! EC 3.4.22.* (cysteine endopeptidase) inhibitor [Term] id: CHEBI:64161 name: asperthecin is_a: CHEBI:132198 ! pentahydroxyanthraquinone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:64178 name: (2S)-2-amino-3-oxo-4-(phosphonatooxy)butanoate(3-) is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64180 name: 2-decaprenyl-6-methoxyhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:64181 name: 2-decaprenyl-6-methoxy-3-methylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:64182 name: 3-demethylubiquinol-10 subset: chebi_ph7_3 is_a: CHEBI:84422 ! 3-demethylubiquinol [Term] id: CHEBI:64183 name: ubiquinol-10 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol is_a: CHEBI:26253 ! polyprenylhydroquinone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:59163 ! biomarker [Term] id: CHEBI:64186 name: (2S)-2-amino-3-oxo-4-(phosphonooxy)butanoic acid is_a: CHEBI:16273 ! 2-amino-3-oxo-4-(phosphonooxy)butanoic acid [Term] id: CHEBI:64221 name: (3R,6S)-6-hydroxy-3,7-dimethyloctanoate subset: chebi_ph7_3 is_a: CHEBI:64223 ! 6-hydroxy-3,7-dimethyloctanoate [Term] id: CHEBI:64223 name: 6-hydroxy-3,7-dimethyloctanoate subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:64224 name: 6-hydroxy-3-isopropenylheptanoate subset: chebi_ph7_3 is_a: CHEBI:58955 ! branched-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:64225 name: (3R,6R)-6-hydroxy-3-isopropenylheptanoate subset: chebi_ph7_3 is_a: CHEBI:64224 ! 6-hydroxy-3-isopropenylheptanoate [Term] id: CHEBI:64226 name: (3S,6R)-6-hydroxy-3-isopropenylheptanoate subset: chebi_ph7_3 is_a: CHEBI:64224 ! 6-hydroxy-3-isopropenylheptanoate [Term] id: CHEBI:64229 name: 6-isopropenyl-3-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:37668 ! terpene lactone is_a: CHEBI:50239 ! epsilon-lactone [Term] id: CHEBI:64230 name: (3R,6S)-6-isopropenyl-3-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:64229 ! 6-isopropenyl-3-methyloxepan-2-one [Term] id: CHEBI:64232 name: (3S,6R)-6-isopropenyl-3-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:64229 ! 6-isopropenyl-3-methyloxepan-2-one [Term] id: CHEBI:64234 name: 3-isopropenyl-6-oxoheptanoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:64235 name: (6E)-8-hydroxygeraniol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26244 ! prenols [Term] id: CHEBI:64236 name: (6E)-8-oxogeraniol subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26244 ! prenols is_a: CHEBI:51688 ! enal [Term] id: CHEBI:64238 name: (6E)-8-hydroxygeranial subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26244 ! prenols is_a: CHEBI:51688 ! enal [Term] id: CHEBI:64239 name: (6E)-8-oxogeranial subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal [Term] id: CHEBI:64240 name: L-threo-7,8-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:64277 ! 7,8-dihydrobiopterin [Term] id: CHEBI:64241 name: (6R)-L-threo-tetrahydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:15372 ! 5,6,7,8-tetrahydrobiopterin [Term] id: CHEBI:64247 name: (3R,6R)-6-hydroxy-3-isopropenylheptanoic acid is_a: CHEBI:50452 ! 6-hydroxy-3-isopropenylheptanoic acid [Term] id: CHEBI:64249 name: (3S,6R)-6-hydroxy-3-isopropenylheptanoic acid is_a: CHEBI:50452 ! 6-hydroxy-3-isopropenylheptanoic acid [Term] id: CHEBI:64252 name: cyclic dehypoxanthinylfutalosine is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:37948 ! oxaspiro compound [Term] id: CHEBI:64253 name: 3-demethylubiquinol-6 subset: chebi_ph7_3 is_a: CHEBI:84422 ! 3-demethylubiquinol [Term] id: CHEBI:64254 name: 1,4-dihydroxy-6-naphthoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:64258 name: erythromycin C(1+) subset: chebi_ph7_3 is_a: CHEBI:64290 ! erythromycin cation [Term] id: CHEBI:64259 name: (6E)-8-oxolinalool subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51688 ! enal [Term] id: CHEBI:64260 name: aminodeoxyfutalosine is_a: CHEBI:22260 ! adenosines is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:64261 name: lupanine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64262 name: 17-hydroxylupanine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64263 name: 5-guanidino-3-methyl-2-oxopentanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:64264 name: 3-isopropenyl-6-oxoheptanoic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid [Term] id: CHEBI:64265 name: (3R,6S)-6-hydroxy-3,7-dimethyloctanoic acid is_a: CHEBI:50451 ! 6-hydroxy-3,7-dimethyloctanoic acid [Term] id: CHEBI:64266 name: tricyclene subset: chebi_ph7_3 is_a: CHEBI:35187 ! monoterpene [Term] id: CHEBI:64267 name: 5-methyltetrahydrosarcinapterin(4-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64268 name: erythromycin A(1+) subset: chebi_ph7_3 is_a: CHEBI:64290 ! erythromycin cation relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:64270 name: cyclic dehypoxanthinylfutalosinate(1-) subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:64273 name: erythromycin C is_a: CHEBI:48923 ! erythromycin [Term] id: CHEBI:64274 name: 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:37668 ! terpene lactone is_a: CHEBI:50239 ! epsilon-lactone [Term] id: CHEBI:64277 name: 7,8-dihydrobiopterin subset: chebi_ph7_3 is_a: CHEBI:22881 ! biopterins is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:64278 name: Reactive Blue 5 quinol form(3-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:64279 name: erythromycin B(1+) subset: chebi_ph7_3 is_a: CHEBI:64290 ! erythromycin cation [Term] id: CHEBI:64280 name: (E)-beta-ocimene subset: chebi_ph7_3 is_a: CHEBI:10436 ! beta-ocimene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:64282 name: (Z)-biformene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene [Term] id: CHEBI:64283 name: copal-8-ol diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64284 name: 1,4-dihydroxy-6-naphthoic acid is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:64285 name: (-)-bornyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64286 name: aminodeoxyfutalosinate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:64287 name: 17-hydroxylupanine is_a: CHEBI:26515 ! quinolizidine alkaloid is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:64288 name: 5-guanidino-3-methyl-2-oxopentanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid relationship: has_part CHEBI:48551 ! guanidino group [Term] id: CHEBI:64289 name: 5-methyltetrahydrosarcinapterin is_a: CHEBI:26914 ! tetrahydromethanopterin [Term] id: CHEBI:64290 name: erythromycin cation is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64291 name: Reactive Blue 5 quinol form is_a: CHEBI:33555 ! arenesulfonic acid is_a: CHEBI:38168 ! chloro-1,3,5-triazine is_a: CHEBI:38170 ! diamino-1,3,5-triazine is_a: CHEBI:46955 ! anthracenes relationship: has_role CHEBI:37958 ! dye [Term] id: CHEBI:64292 name: coniferyl ester subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:64293 name: copal-8-ol diphosphate is_a: CHEBI:36770 ! labdane diterpenoid is_a: CHEBI:36772 ! diterpenyl phosphate [Term] id: CHEBI:64294 name: 7-ketocholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:64298 name: (-)-bornyl diphosphate is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:25412 ! monoterpenyl phosphate [Term] id: CHEBI:64302 name: cyanamide(2-) is_a: CHEBI:50335 ! organic nitrogen anion [Term] id: CHEBI:64307 name: 2,4-diaminobutyric acid is_a: CHEBI:33707 ! gamma-amino acid is_a: CHEBI:35987 ! diamino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:64315 name: 4-demethylwyosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:64328 name: lysidine is_a: CHEBI:23524 ! cytidines is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:64335 name: N(1)-aminopropylagmatine(3+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:64339 name: N(1)-aminoaminopropylagmatine is_a: CHEBI:24436 ! guanidines [Term] id: CHEBI:64344 name: 2',4',6'-trihydroxyacetophenone subset: chebi_ph7_3 is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:64345 ! MALDI matrix material relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:64345 name: MALDI matrix material is_a: CHEBI:33232 ! application [Term] id: CHEBI:64351 name: beta-D-Manp-(1->4)-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:64353 name: UDP-N-acetyl-alpha-D-glucosamine 3-phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:64361 name: beta-sesquiphellandrene subset: chebi_ph7_3 is_a: CHEBI:33654 ! alicyclic compound is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:64362 name: UDP-N-acetyl-alpha-D-glucosamine 3-phosphate is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:64365 name: aralkylamino compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:64368 name: 3-hydroxyproline is_a: CHEBI:86499 ! monohydroxyproline [Term] id: CHEBI:64372 name: emericellamide is_a: CHEBI:24995 ! lactam is_a: CHEBI:35213 ! cyclodepsipeptide is_a: CHEBI:46895 ! lipopeptide is_a: CHEBI:63944 ! macrocyclic lactone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64373 name: emericellamide A subset: chebi_ph7_3 is_a: CHEBI:64372 ! emericellamide [Term] id: CHEBI:64379 name: 1-acyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:68497 ! lysophosphatidylserine(1-) is_a: CHEBI:78213 ! 1-acylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:64381 name: 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion is_a: CHEBI:78170 ! 1-acylglycerophosphoethanolamine zwitterion [Term] id: CHEBI:64396 name: 1-oleyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine is_a: CHEBI:64591 ! lysophosphatidylcholine O-18:1 [Term] id: CHEBI:64397 name: asperfuranone subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:23824 ! diol is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38831 ! 2-benzofurans is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64398 name: monodictyphenone is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:22726 ! benzophenones is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64405 name: F-9775A subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:38164 ! organic heteropentacyclic compound relationship: has_role CHEBI:64406 ! EC 3.4.22.38 (cathepsin K) inhibitor relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64406 name: EC 3.4.22.38 (cathepsin K) inhibitor is_a: CHEBI:64152 ! cysteine protease inhibitor is_a: CHEBI:76796 ! EC 3.4.22.* (cysteine endopeptidase) inhibitor [Term] id: CHEBI:64409 name: F-9775B subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:38164 ! organic heteropentacyclic compound relationship: has_role CHEBI:64406 ! EC 3.4.22.38 (cathepsin K) inhibitor relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64410 name: gerfelin is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:33566 ! catechols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:64411 ! EC 2.5.1.29 (geranylgeranyl diphosphate synthase) inhibitor [Term] id: CHEBI:64411 name: EC 2.5.1.29 (geranylgeranyl diphosphate synthase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:64413 name: diorcinol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64415 name: violaceol I is_a: CHEBI:33566 ! catechols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:64416 name: EC 1.3.1.43 (arogenate dehydrogenase) inhibitor is_a: CHEBI:76857 ! EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:64417 name: violaceol II is_a: CHEBI:33566 ! catechols is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:64418 name: austinol subset: chebi_ph7_3 is_a: CHEBI:64419 ! meroterpenoid [Term] id: CHEBI:64419 name: meroterpenoid is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64421 name: dehydroaustinol subset: chebi_ph7_3 is_a: CHEBI:64419 ! meroterpenoid [Term] id: CHEBI:64423 name: phosphatidylcholine 34:4 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64424 name: phosphatidylcholine 34:3 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:64426 name: cyclitol ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:64427 name: phosphatidyl-N,N-dimethylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:64428 name: H group subset: chebi_ph7_3 is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:64429 name: chanoclavine-I aldehyde is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:51688 ! enal [Term] id: CHEBI:64433 name: phosphatidylcholine 36:2 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64436 name: arugosin is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:6444 name: Levorphanol is_a: CHEBI:25418 ! morphinane alkaloid [Term] id: CHEBI:64448 name: arsonate(1-) subset: chebi_ph7_3 is_a: CHEBI:35776 ! arsenic oxoanion [Term] id: CHEBI:64450 name: endocrocin is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:37488 ! trihydroxyanthraquinone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64454 name: (+)-kotanin subset: chebi_ph7_3 is_a: CHEBI:64462 ! 8,8'-bicoumarins relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64459 name: biaryl is_a: CHEBI:33659 ! organic aromatic compound [Term] id: CHEBI:64461 name: bicoumarin is_a: CHEBI:38104 ! oxacycle is_a: CHEBI:64459 ! biaryl [Term] id: CHEBI:64462 name: 8,8'-bicoumarins is_a: CHEBI:64461 ! bicoumarin [Term] id: CHEBI:64465 name: demethylkotanin is_a: CHEBI:64462 ! 8,8'-bicoumarins relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64473 name: orlandin is_a: CHEBI:64462 ! 8,8'-bicoumarins relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:64474 name: p-hydroxyphenyl lignin is_a: CHEBI:6457 ! lignin [Term] id: CHEBI:64475 name: guaiacyl lignin is_a: CHEBI:6457 ! lignin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:64476 name: syringal lignin is_a: CHEBI:6457 ! lignin relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:64477 name: monolignol is_a: CHEBI:76924 ! plant metabolite [Term] id: CHEBI:64479 name: O-(pantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:64480 name: phosphatidylcholine O-38:4 subset: chebi_ph7_3 is_a: CHEBI:68489 ! alkyl,acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64482 name: phosphatidylcholine subset: chebi_ph7_3 is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:64483 name: lysophosphatidylcholine 14:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64489 name: 1-myristoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64483 ! lysophosphatidylcholine 14:0 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:64492 name: ferricrocin subset: chebi_ph7_3 is_a: CHEBI:61414 ! ferrichromes relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64493 name: sarcinapterin is_a: CHEBI:37669 ! methanopterins [Term] id: CHEBI:64494 name: tatiopterin is_a: CHEBI:26375 ! pterins [Term] id: CHEBI:64496 name: lysophosphatidylcholine O-16:0/0:0 subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine is_a: CHEBI:64593 ! lysophosphatidylcholine O-16:0 relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64497 name: cspyrone B1 is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:75885 ! 2-pyranones is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64499 name: shamixanthone subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:64515 ! pyranoxanthene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64502 name: 1-heptadecene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:64503 name: nonadec-1-ene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:64504 name: phosphatidylcholine 36:5 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64506 name: (Z)-nonadeca-1,14-diene subset: chebi_ph7_3 is_a: CHEBI:33646 ! alkadiene [Term] id: CHEBI:64507 name: 18-methylnonadec-1-ene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:64508 name: 17-methylnonadec-1-ene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:64509 name: oxapenam subset: chebi_ph7_3 is_a: CHEBI:35627 ! beta-lactam [Term] id: CHEBI:64510 name: carbapenam is_a: CHEBI:35627 ! beta-lactam [Term] id: CHEBI:64512 name: emericellin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:51149 ! xanthones relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64514 name: sarcinapterin(4-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64515 name: pyranoxanthene is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:64516 name: phosphatidylcholine 34:2 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64517 name: phosphatidylcholine 34:1 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64518 name: cordyol C subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38068 ! antimalarial relationship: has_role CHEBI:64912 ! antimycobacterial drug relationship: has_role CHEBI:64953 ! anti-HSV-1 agent [Term] id: CHEBI:64519 name: phosphatidylcholine 38:6 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64520 name: phosphatidylcholine 36:4 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64522 name: averantin is_a: CHEBI:26188 ! polyketide is_a: CHEBI:37496 ! tetrahydroxyanthraquinone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64523 name: phosphatidylcholine 36:3 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64525 name: phosphatidylcholine 38:5 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:64526 name: phosphatidylcholine 38:4 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64530 name: brevianamide F subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48337 ! pyrrolopyrazine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64531 name: fumitremorgin B subset: chebi_ph7_3 is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:64532 name: dihydroxytoluene is_a: CHEBI:24751 ! hydroxytoluene is_a: CHEBI:33570 ! benzenediols [Term] id: CHEBI:64534 name: terrequinone A is_a: CHEBI:51879 ! bisindole alkaloid is_a: CHEBI:67273 ! monohydroxy-1,4-benzoquinones relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:64535 name: pseurotin A subset: chebi_ph7_3 is_a: CHEBI:24995 ! lactam is_a: CHEBI:35624 ! azaspiro compound is_a: CHEBI:37948 ! oxaspiro compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64542 name: naphtho-gamma-pyrone is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:86027 ! naphthopyran [Term] id: CHEBI:64543 name: fonsecin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:59780 ! cyclic hemiketal is_a: CHEBI:59872 ! heptaketide is_a: CHEBI:64542 ! naphtho-gamma-pyrone relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:64545 name: fumiquinazoline is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38166 ! organic heteropolycyclic compound is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:64547 name: imidazoindole is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:64549 name: lysophosphatidylcholine 18:2 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64551 name: fumiquinazoline C subset: chebi_ph7_3 is_a: CHEBI:35624 ! azaspiro compound is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:52157 ! organic heteroheptacyclic compound is_a: CHEBI:64545 ! fumiquinazoline is_a: CHEBI:64547 ! imidazoindole [Term] id: CHEBI:64552 name: 2-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:133791 ! 2-hydroxybutyrates relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64553 name: tatiopterin(5-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64554 name: tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:64555 name: trans-p-coumaryl alcohol subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:28386 ! 4-hydroxycinnamyl alcohol is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:64477 ! monolignol [Term] id: CHEBI:64557 name: trans-sinapyl alcohol subset: chebi_ph7_3 is_a: CHEBI:28813 ! sinapyl alcohol relationship: has_role CHEBI:64477 ! monolignol [Term] id: CHEBI:64558 name: methionine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:64560 name: lysophosphatidylcholine 16:1 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64561 name: lysophosphatidylcholine 18:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64563 name: lysophosphatidylcholine 16:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64565 name: lysophosphatidylcholine 18:3 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64566 name: lysophosphatidylcholine 18:1 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64567 name: lysophosphatidylcholine 22:6 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64568 name: lysophosphatidylcholine 20:4 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:64569 name: lysophosphatidylethanolamine 20:4 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:6457 name: lignin is_a: CHEBI:26196 ! polyphenylpropanoid [Term] id: CHEBI:64570 name: EC 2.1.2.1 (glycine hydroxymethyltransferase) inhibitor is_a: CHEBI:76874 ! EC 2.1.2.* (hydroxymethyl-, formyl- and related transferases) inhibitor [Term] id: CHEBI:64571 name: NMDA receptor agonist is_a: CHEBI:50103 ! excitatory amino acid agonist [Term] id: CHEBI:64572 name: 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:64573 name: 1,2-diacyl-sn-glycero-3-phospho-N-methylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:64574 name: lysophosphatidylethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:64575 name: lysophosphatidylethanolamine 18:1 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64576 name: lysophosphatidylethanolamine 18:0 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64577 name: flour treatment agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:64583 name: sphingomyelin subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36700 ! phosphocholines [Term] id: CHEBI:64584 name: uremic toxin is_a: CHEBI:27026 ! toxin [Term] id: CHEBI:64588 name: glycine transporter 1 inhibitor is_a: CHEBI:85425 ! glycine transporter inhibitor [Term] id: CHEBI:64589 name: glycine receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:64590 name: monoalkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:78196 ! monoalkylglycerophosphocholine [Term] id: CHEBI:64591 name: lysophosphatidylcholine O-18:1 subset: chebi_ph7_3 is_a: CHEBI:64590 ! monoalkyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64593 name: lysophosphatidylcholine O-16:0 subset: chebi_ph7_3 is_a: CHEBI:64590 ! monoalkyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64595 name: 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine is_a: CHEBI:17152 ! phosphatidyl-N,N-dimethylethanolamine [Term] id: CHEBI:64596 name: 1,2-diacyl-sn-glycero-3-phospho-N-methylethanolamine is_a: CHEBI:15958 ! phosphatidyl-N-methylethanolamine [Term] id: CHEBI:64598 name: 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:25235 ! monomethoxybenzene is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:64672 ! differentiation-inducing factor relationship: has_role CHEBI:62488 ! signalling molecule relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:64599 name: 4-amino-3-isothiazolidinone is_a: CHEBI:48891 ! thiazolidinone [Term] id: CHEBI:64600 name: C21-steroid hormone is_a: CHEBI:26764 ! steroid hormone is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:64602 name: dermatan sulfate proteoglycan is_a: CHEBI:37396 ! proteoglycan [Term] id: CHEBI:64603 name: diadenosyl polyphosphate is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:64604 name: diphosphoinositol polyphosphate is_a: CHEBI:24846 ! inositol phosphate [Term] id: CHEBI:64606 name: Fe3S4 iron-sulfur cluster is_a: CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:64607 name: Fe4S4 iron-sulfur cluster is_a: CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:64608 name: GDP-fucose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:64609 name: dinitrosyl-iron complex is_a: CHEBI:33892 ! iron coordination entity [Term] id: CHEBI:64610 name: tenocyclidine is_a: CHEBI:26151 ! piperidines is_a: CHEBI:26961 ! thiophenes is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:60643 ! NMDA receptor antagonist relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:64611 name: ether lipid is_a: CHEBI:18059 ! lipid is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:64612 name: 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:57613 ! phosphatidylethanolamine zwitterion [Term] id: CHEBI:64615 name: triacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:64616 name: apiogalacturonan is_a: CHEBI:18154 ! polysaccharide [Term] id: CHEBI:64618 name: phosphagen is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:51143 ! nitrogen molecular entity is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:64620 name: purine ribonucleoside bisphosphate is_a: CHEBI:61078 ! purine nucleoside bisphosphate is_a: CHEBI:61079 ! ribonucleoside bisphosphate [Term] id: CHEBI:64621 name: quercetin O-glucoside is_a: CHEBI:76424 ! quercetin O-glycoside [Term] id: CHEBI:64622 name: reuteran is_a: CHEBI:22385 ! alpha-D-glucan [Term] id: CHEBI:64623 name: saturated monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:64624 name: microcin B17 is_a: CHEBI:64627 ! microcin relationship: has_role CHEBI:59517 ! DNA synthesis inhibitor [Term] id: CHEBI:64626 name: teichuronic acid is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:64627 name: microcin is_a: CHEBI:25903 ! peptide antibiotic [Term] id: CHEBI:64628 name: somatostatin is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25905 ! peptide hormone [Term] id: CHEBI:64629 name: 2-(4-iodo-2,5-dimethoxyphenyl)-1-methylethylamine is_a: CHEBI:35338 ! amphetamines is_a: CHEBI:37142 ! organoiodine compound is_a: CHEBI:51681 ! dimethoxybenzene [Term] id: CHEBI:64631 name: indoleacetic acid conjugate is_a: CHEBI:24828 ! indoles relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64632 name: indoleacetic acid amide conjugate is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:64631 ! indoleacetic acid conjugate [Term] id: CHEBI:64633 name: indoleacetic acid ester conjugate is_a: CHEBI:46939 ! indolyl carboxylate ester is_a: CHEBI:64631 ! indoleacetic acid conjugate [Term] id: CHEBI:64634 name: kaempferol O-glucoside is_a: CHEBI:50018 ! glycosyloxyflavone [Term] id: CHEBI:64637 name: O-polysaccharide is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:64640 name: hypusine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:64641 name: divalent inorganic cation is_a: CHEBI:36915 ! inorganic cation [Term] id: CHEBI:64642 name: (3R)-3-methyl-D-ornithine(1+) subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:64643 name: N(6)-[(3R)-3-methyl-D-ornithyl]-L-lysine(2+) subset: chebi_ph7_3 is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:64645 name: amyloid-beta is_a: CHEBI:15841 ! polypeptide [Term] id: CHEBI:64648 name: enniatin is_a: CHEBI:24995 ! lactam is_a: CHEBI:35213 ! cyclodepsipeptide is_a: CHEBI:63944 ! macrocyclic lactone relationship: has_role CHEBI:24869 ! ionophore relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:64654 name: guanosine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:64656 name: cytidine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:64668 name: geranylgeranyl-chlorophyll a is_a: CHEBI:28966 ! chlorophyll is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:64669 name: 2-hydroxy-3-methylbutyrate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64670 name: EC 1.8.1.9 (thioredoxin reductase) inhibitor is_a: CHEBI:76869 ! EC 1.8.1.* (oxidoreductase acting on sulfur group of donors, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:64672 name: differentiation-inducing factor is_a: CHEBI:33853 ! phenols is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:51683 ! methoxybenzenes is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:35224 ! effector relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:64673 name: fumigaclavine C is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64674 name: 1,2-diacyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:16038 ! phosphatidylethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:64675 name: 2,6-dioxo-6-phenylhexa-3-enoate(1-) subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:64676 name: CDP-N,N-dimethylethanolamine is_a: CHEBI:25604 ! nucleotide-(amino alcohol)s is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:64677 name: daunorubicin(1+) subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:64678 name: anthracycline cation is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64683 name: 1-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride [Term] id: CHEBI:64684 name: 7-formamidino-7-deazaguanine(1+) subset: chebi_ph7_3 is_a: CHEBI:77718 ! carboxamidinium ion [Term] id: CHEBI:64686 name: 7-formamidino-7-deazaguanine is_a: CHEBI:35359 ! carboxamidine is_a: CHEBI:38670 ! pyrrolopyrimidine [Term] id: CHEBI:64687 name: 2,6-dioxo-6-phenylhexa-3-enoic acid is_a: CHEBI:35951 ! dioxo monocarboxylic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:64688 name: artemisinic aldehyde subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:64689 name: mycophenolic acid O-acyl-glucuronide is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33853 ! phenols is_a: CHEBI:37581 ! gamma-lactone [Term] id: CHEBI:64691 name: (11R)-dihydroartemisinic aldehyde subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:64692 name: N(6)-[(3R)-3-methyl-D-ornithyl]-L-lysine is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:64693 name: (3R)-3-methyl-D-ornithine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:84113 ! D-isoleucine derivative [Term] id: CHEBI:64694 name: 3,4-dihydroxy-5-polyprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:64695 name: pyripyropene A subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:64697 ! acyl-CoA:cholesterol acyltransferase 2 inhibitor [Term] id: CHEBI:64696 name: EC 2.3.1.26 (sterol O-acyltransferase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:64697 name: acyl-CoA:cholesterol acyltransferase 2 inhibitor is_a: CHEBI:64696 ! EC 2.3.1.26 (sterol O-acyltransferase) inhibitor [Term] id: CHEBI:64702 name: nucleotide-sulfate is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:36976 ! nucleotide [Term] id: CHEBI:64704 name: aspyridone A subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:38183 ! pyridone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64705 name: aspyridone B subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:38183 ! pyridone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:64708 name: one-carbon compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:64709 name: organic acid is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:64711 name: purine nucleotide-sugar is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:64712 name: trivalent inorganic cation is_a: CHEBI:36915 ! inorganic cation [Term] id: CHEBI:64716 name: 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:145394 ! 1,2-diacyl-sn-glycero-3-phosphoglycerol(1-) is_a: CHEBI:60523 ! phosphatidylglycerol(1-) [Term] id: CHEBI:64717 name: sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:61933 ! glycerophosphoglycerol(1-) [Term] id: CHEBI:64718 name: L-alaniniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:64719 name: L-argininiumyl(2+) group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:6472 name: lincomycin is_a: CHEBI:23007 ! carbohydrate-containing antibiotic is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:35275 ! S-glycosyl compound is_a: CHEBI:46770 ! pyrrolidinecarboxamide is_a: CHEBI:84186 ! L-proline derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:64720 name: L-alpha-aspartyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:64721 name: L-alpha-glutamyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:64722 name: L-glutaminiumyl group subset: chebi_ph7_3 is_a: CHEBI:33715 ! N-terminal alpha-amino-acid residue [Term] id: CHEBI:64723 name: glyciniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:64726 name: thioselenide is_a: CHEBI:26628 ! selenium molecular entity is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:64729 name: glutathioselenol is_a: CHEBI:24337 ! glutathione derivative is_a: CHEBI:64726 ! thioselenide relationship: has_part CHEBI:29775 ! selenol group relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:64731 name: L-methioniniumyl group subset: chebi_ph7_3 is_a: CHEBI:78597 ! N-terminal alpha-amino-acid(1+) residue [Term] id: CHEBI:64738 name: L-seriniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:64739 name: L-threoniniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:64741 name: L-valiniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:64743 name: 2-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:167057 ! Monolysocardiolipin(2-) is_a: CHEBI:76529 ! glycerophosphoglycerophosphoglycerol(2-) [Term] id: CHEBI:64744 name: phytochelatin 2 is_a: CHEBI:48545 ! pentapeptide is_a: CHEBI:60836 ! phytochelatin [Term] id: CHEBI:64745 name: phytochelatin 3 is_a: CHEBI:25676 ! oligopeptide is_a: CHEBI:60836 ! phytochelatin [Term] id: CHEBI:64747 name: phytochelatin 4 is_a: CHEBI:25676 ! oligopeptide is_a: CHEBI:60836 ! phytochelatin [Term] id: CHEBI:64755 name: EDTA(2-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion [Term] id: CHEBI:64757 name: 3-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:69081 ! 1-monopalmitoylglycerol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64760 name: 3-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride [Term] id: CHEBI:64763 name: EC 3.1.4.11 (phosphoinositide phospholipase C) inhibitor is_a: CHEBI:50218 ! EC 3.1.4.* (phosphoric diester hydrolase) inhibitor [Term] id: CHEBI:64765 name: sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:61931 ! glycerol 1-phosphoserine(1-) is_a: CHEBI:83408 ! sn-glycerophosphodiester(1-) [Term] id: CHEBI:64766 name: cationic group is_a: CHEBI:24433 ! group [Term] id: CHEBI:64767 name: anionic group is_a: CHEBI:24433 ! group [Term] id: CHEBI:64768 name: zwitterionic group is_a: CHEBI:24433 ! group [Term] id: CHEBI:64769 name: organic cationic group is_a: CHEBI:64766 ! cationic group [Term] id: CHEBI:64771 name: 1-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:58944 ! dialkyl phosphate anion is_a: CHEBI:68498 ! lysophosphatidyl-1D-myo-inositol(1-) is_a: CHEBI:78232 ! 1-acylglycero-3-phospho-1-inositol(1-) [Term] id: CHEBI:64775 name: organic anionic group is_a: CHEBI:64767 ! anionic group [Term] id: CHEBI:64776 name: inorganic anionic group is_a: CHEBI:64767 ! anionic group [Term] id: CHEBI:64781 name: 3-heptaprenyl-sn-glycero-1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:64782 name: (+)-artemisinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:64783 name: (+)-artemisinic alcohol subset: chebi_ph7_3 is_a: CHEBI:134394 ! primary allylic alcohol is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:64784 name: [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:64785 name: [(2R)-3,3,4-trimethyl-6-oxo-3,6-dihydro-1H-pyran-2-yl]acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:64786 name: (+)-6-exo-hydroxycamphor subset: chebi_ph7_3 is_a: CHEBI:64814 ! 6-hydroxycamphor [Term] id: CHEBI:64787 name: (+)-6-endo-hydroxycamphor subset: chebi_ph7_3 is_a: CHEBI:64814 ! 6-hydroxycamphor [Term] id: CHEBI:64788 name: 3,4-dihydro-4-hydroxyphenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:64789 name: 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:64790 name: tetrahydro-4-hydroxyphenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:64791 name: tetrahydrotyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:64792 name: 2-oxospirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:64793 name: 2,2'-dioxospirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:35310 ! carotenone is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:64794 name: salicin-6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64795 name: phytosphingosine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) [Term] id: CHEBI:64796 name: 2-deoxy-scyllo-inosose subset: chebi_ph7_3 is_a: CHEBI:64809 ! tetrahydroxycyclohexanone [Term] id: CHEBI:64797 name: alpha-muurolene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:64798 name: gamma-muurolene subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:64799 name: beta-copaene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:64800 name: sativene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35990 ! bridged compound [Term] id: CHEBI:64801 name: (R)-tetraprenyl-beta-curcumene subset: chebi_ph7_3 is_a: CHEBI:37613 ! cyclohexadiene is_a: CHEBI:64804 ! sesquarterpene [Term] id: CHEBI:64802 name: L-histidinal(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64804 name: sesquarterpene is_a: CHEBI:35186 ! terpene [Term] id: CHEBI:64806 name: 2-demethylmenaquinol-7 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:64807 name: tetrahydrotyrosine is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:64808 name: tetrahydro-4-hydroxyphenylpyruvic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:64809 name: tetrahydroxycyclohexanone is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:64814 name: 6-hydroxycamphor subset: chebi_ph7_3 is_a: CHEBI:22912 ! bornane monoterpenoid is_a: CHEBI:23446 ! cyclic monoterpene ketone [Term] id: CHEBI:64815 name: [(R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetate subset: chebi_ph7_3 is_a: CHEBI:19733 ! (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetate [Term] id: CHEBI:64816 name: doxorubicin(1+) subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:64817 name: [(R)-2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl]acetic acid is_a: CHEBI:28045 ! (2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid [Term] id: CHEBI:64819 name: [(2R)-3,3,4-trimethyl-6-oxo-3,6-dihydro-1H-pyran-2-yl]acetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:64833 name: 6-kestotriose subset: chebi_ph7_3 is_a: CHEBI:27150 ! trisaccharide [Term] id: CHEBI:64834 name: menaquinol-7 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:64835 name: 1,6-kestotetraose subset: chebi_ph7_3 is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:64836 name: 6,6-kestotetraose subset: chebi_ph7_3 is_a: CHEBI:50126 ! tetrasaccharide [Term] id: CHEBI:64837 name: N(pros)-phosphonato-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:64838 name: 1D-myo-inositol 6-phosphate is_a: CHEBI:25446 ! myo-inositol monophosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64839 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:64840 name: 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:77592 ! monacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:78211 ! 1-acylglycero-3-phospho-1'-glycerol(1-) [Term] id: CHEBI:64841 name: 1D-myo-inositol 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion is_a: CHEBI:84139 ! myo-inositol phosphate(2-) [Term] id: CHEBI:64844 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:64845 name: 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:62747 ! 1-acyl-sn-glycero-3-phosphoglycerol [Term] id: CHEBI:64846 name: glycyl-AMP(1-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64847 name: L-threonyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64848 name: N-acetyl-beta-muramate(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:64849 name: glycyl-AMP is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:64850 name: N-carbamoylaspartic acid is_a: CHEBI:21689 ! N-carbamoyl-amino acid is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64851 name: L-threonyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:64853 name: N(epsilon)-(5'-guanylyl)-N(alpha)-acetyl-L-lysine methyl ester(1-) subset: chebi_ph7_3 is_a: CHEBI:60345 ! organic phosphoramidate anion [Term] id: CHEBI:64854 name: N(alpha)-acetyl-L-lysine methyl ester(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64856 name: N(epsilon)-GMP-N(alpha)-acetyl-L-lysine methyl ester is_a: CHEBI:22160 ! acetamides is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:37773 ! organic phosphoramidate [Term] id: CHEBI:64857 name: cosmetic is_a: CHEBI:33232 ! application [Term] id: CHEBI:64858 name: aminopropylcadaverine(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:64859 name: N(alpha)-acetyl-L-lysine methyl ester is_a: CHEBI:22160 ! acetamides is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:46874 ! alpha-amino acid ester is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:64860 name: aminopropylcadaverine is_a: CHEBI:38751 ! triamine is_a: CHEBI:39474 ! polyazaalkane relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:64861 name: 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:64862 name: 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:64863 name: 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:64864 name: 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:64865 name: 1-acyl-2-dodecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:64868 name: hexacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:64869 name: 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:64870 name: (S)-malyl N-acetyl-alpha-D-glucosaminide(2-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:64871 name: (S)-malyl alpha-D-glucosaminide(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:64872 name: 2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:68498 ! lysophosphatidyl-1D-myo-inositol(1-) is_a: CHEBI:78233 ! 2-acylglycero-3-phospho-1-inositol(1-) [Term] id: CHEBI:64873 name: 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:64874 name: 1-acyl-2-hexadecanoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:64875 name: 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:64876 name: bacillithiol(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:64877 name: 1-acyl-2-dodecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:64882 name: (S)-malyl N-acetyl-alpha-D-glucosaminide is_a: CHEBI:27425 ! N-acetyl-alpha-D-glucosaminide [Term] id: CHEBI:64883 name: diacetylchitobiose-6'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:64884 name: C20 phytosphingosine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) [Term] id: CHEBI:64885 name: C20 phytosphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:64886 name: C20 sphinganine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) [Term] id: CHEBI:64887 name: C20 sphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:64888 name: (S)-malyl alpha-D-glucosaminide is_a: CHEBI:35373 ! D-glucosaminide is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:64889 name: 1-acyl-2-hexadecanoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:64890 name: 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:64891 name: O-(pantetheine-4'-phosphoryl)serine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:64893 name: bornane-2,6-dione subset: chebi_ph7_3 is_a: CHEBI:46640 ! diketone [Term] id: CHEBI:64894 name: [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:64896 name: O-(pantetheine-4'-phosphoryl)serine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative relationship: has_part CHEBI:47982 ! pantetheine 4'-phosphate group [Term] id: CHEBI:64897 name: diacetylchitobiose-6'-phosphate is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:64898 name: anionic amino-acid residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:64899 name: [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid is_a: CHEBI:33823 ! enol is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid [Term] id: CHEBI:64900 name: [(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:64905 name: C20 sphinganine is_a: CHEBI:64907 ! 2-aminoicosane-1,3-diol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:64907 name: 2-aminoicosane-1,3-diol is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:64908 name: (3E)-2-oxohex-3-enedioate subset: chebi_ph7_3 is_a: CHEBI:64928 ! 2-oxohex-3-enedioate [Term] id: CHEBI:64909 name: poison is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:64910 name: C20 phytosphingosine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:64911 name: antimitotic is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:64912 name: antimycobacterial drug is_a: CHEBI:36047 ! antibacterial drug [Term] id: CHEBI:64915 name: antiplasmodial drug is_a: CHEBI:35442 ! antiparasitic agent is_a: CHEBI:35820 ! antiprotozoal drug [Term] id: CHEBI:64916 name: inositol phosphoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:64917 name: C20 sphinganine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate [Term] id: CHEBI:64918 name: C20 phytosphingosine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate [Term] id: CHEBI:64919 name: EC 2.3.1.20 (diacylglycerol O-acyltransferase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:64921 name: 3,4-dihydroxy-5-polyprenylbenzoic acid is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:64925 name: 4beta-methylzymosterol-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:64926 name: serine protease inhibitor is_a: CHEBI:37670 ! protease inhibitor [Term] id: CHEBI:64927 name: 2-oxohex-3-enedioic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:64928 name: 2-oxohex-3-enedioate subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:64930 is_obsolete: true replaced_by: CHEBI:28914 [Term] id: CHEBI:64931 name: lysophosphatidyl-1D-myo-inositol is_a: CHEBI:36315 ! glycerophosphoinositol [Term] id: CHEBI:64933 name: melanin synthesis inhibitor is_a: CHEBI:59864 ! depigmentation drug [Term] id: CHEBI:64936 name: N(pros)-phospho-L-histidine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:64937 name: 3-heptaprenyl-sn-glycero-1-phosphate is_a: CHEBI:36571 ! prenylglycerol phosphate [Term] id: CHEBI:64938 name: N(pros)-phospho-L-histidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:64939 name: 3,4-dihydro-4-hydroxyphenylpyruvic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:64940 name: inositol phosphophytoceramide (t18:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:139053 ! inositol-1-phosphophytoceramide(1-) is_a: CHEBI:64993 ! inositol phosphophytoceramide(1-) [Term] id: CHEBI:64941 name: inositol phosphodihydroceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:139052 ! inositol-1-phosphodihydroceramide(1-) is_a: CHEBI:82829 ! sphinganine-based sphingolipid [Term] id: CHEBI:64942 name: 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:64945 name: sn-glycero-3-phosphoserine is_a: CHEBI:62013 ! glycerol 1-phosphoserine [Term] id: CHEBI:64946 name: anti-HIV agent is_a: CHEBI:22587 ! antiviral agent [Term] id: CHEBI:64947 name: anti-HIV-1 agent is_a: CHEBI:64946 ! anti-HIV agent [Term] id: CHEBI:64948 name: pyrrolizidine alkaloid is_a: CHEBI:22315 ! alkaloid [Term] id: CHEBI:6495 name: lipoprotein is_a: CHEBI:33837 ! conjugated protein is_a: CHEBI:39024 ! clathrate compound relationship: has_part CHEBI:39015 ! apolipoprotein relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:64950 name: pyrrolizidine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:64951 name: anti-HBV agent is_a: CHEBI:22587 ! antiviral agent [Term] id: CHEBI:64952 name: anti-HSV agent is_a: CHEBI:22587 ! antiviral agent [Term] id: CHEBI:64953 name: anti-HSV-1 agent is_a: CHEBI:64952 ! anti-HSV agent [Term] id: CHEBI:64956 name: sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:5457 ! glycerophosphoglycerol [Term] id: CHEBI:64958 name: N-(2-hydroxyhexacosanoyl)phytosphingosine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:64961 name: 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:64962 name: glucobrassicin(1-) subset: chebi_ph7_3 is_a: CHEBI:24796 ! indolylmethylglucosinolate [Term] id: CHEBI:64964 name: EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor is_a: CHEBI:35856 ! lipoxygenase inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:64967 name: 4-carboxyzymosterol(1-) subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:64969 name: inositol phosphodihydroceramide is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:6497 name: lipoxin is_a: CHEBI:61703 ! nonclassic icosanoid relationship: has_role CHEBI:140399 ! specialised pro-resolving mediator [Term] id: CHEBI:64970 name: inositol phosphophytoceramide (t18:0) is_a: CHEBI:64994 ! inositol phosphophytoceramide [Term] id: CHEBI:64971 name: ergosta-5,7,22,24(28)-tetraen-3beta-yl acetate subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester [Term] id: CHEBI:64973 name: bicyclic nitroimidazole is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:64974 name: (-)-microperfuranone subset: chebi_ph7_3 is_a: CHEBI:50523 ! butenolide is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:64975 name: lanosteryl palmitate subset: chebi_ph7_3 is_a: CHEBI:52394 ! lanosteryl ester [Term] id: CHEBI:64976 name: ergosteryl palmitate subset: chebi_ph7_3 is_a: CHEBI:52320 ! ergosteryl ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64977 name: cichorine subset: chebi_ph7_3 is_a: CHEBI:24897 ! isoindoles is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:6498 name: lipoxin A4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:6497 ! lipoxin relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64980 name: gammaGluCys(IAN)Gly is_a: CHEBI:18379 ! nitrile is_a: CHEBI:24335 ! glutathione conjugate is_a: CHEBI:24828 ! indoles relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:64981 name: gammaGluCys(IAN)Gly(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:64982 name: 2-acyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77589 ! monoacyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:78167 ! 1-lysophosphatidate(2-) [Term] id: CHEBI:64985 name: bioconjugate is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:64987 name: S-conjugate is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:64988 name: L-Cys(IAN) is_a: CHEBI:18379 ! nitrile is_a: CHEBI:24828 ! indoles is_a: CHEBI:27532 ! L-cysteine thioether is_a: CHEBI:64987 ! S-conjugate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6499 name: lipoxin B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:6497 ! lipoxin relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:64991 name: mannosylinositol phosphophytoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64997 ! mannosylinositol phosphorylceramide(1-) [Term] id: CHEBI:64992 name: inositol phosphomannosylinositol phosphophytoceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:64993 name: inositol phosphophytoceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:64916 ! inositol phosphoceramide(1-) [Term] id: CHEBI:64994 name: inositol phosphophytoceramide is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:64995 name: EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor is_a: CHEBI:35856 ! lipoxygenase inhibitor [Term] id: CHEBI:64996 name: EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor is_a: CHEBI:35856 ! lipoxygenase inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:64997 name: mannosylinositol phosphorylceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:64998 name: nicotine blue(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:64999 name: 3,3'-bipyridine-2,2',5,5',6,6'-hexol subset: chebi_ph7_3 is_a: CHEBI:50511 ! bipyridines [Term] id: CHEBI:65000 name: mannosylinositol phosphophytoceramide is_a: CHEBI:25168 ! mannosylinositol phosphorylceramide [Term] id: CHEBI:65001 name: EC 3.1.1.3 (triacylglycerol lipase) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:65002 name: 3-ammonio-2,3-dideoxy-scyllo-inosose(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65003 name: 2-deoxy-scyllo-inosamine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65004 name: (-)-secoisolariciresinol subset: chebi_ph7_3 is_a: CHEBI:67250 ! secoisolariciresinol relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:65006 name: inositol phosphomannosylinositol phosphophytoceramide is_a: CHEBI:62682 ! inositol phosphomannosylinositol phosphoceramide [Term] id: CHEBI:65008 name: 6'-oxoparomamine is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:38751 ! triamine is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:65009 name: indol-3-ylmethylamine is_a: CHEBI:38631 ! aminoalkylindole is_a: CHEBI:64365 ! aralkylamino compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:65010 name: 2'-N-acetylparomamine(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65011 name: nicotine blue is_a: CHEBI:65013 ! extended quinone relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:65013 name: extended quinone is_a: CHEBI:36820 ! ring assembly is_a: CHEBI:3992 ! cyclic ketone [Term] id: CHEBI:65015 name: paromamine(3+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65016 name: 6'-oxoparomamine(3+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65018 name: 2'-N-acetylparomamine is_a: CHEBI:47779 ! aminoglycoside [Term] id: CHEBI:65023 name: anti-asthmatic agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:65027 name: 3-amino-2,3-dideoxy-scyllo-inosose is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:65029 ! trihydroxycyclohexanone [Term] id: CHEBI:65028 name: ribostamycin(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65029 name: trihydroxycyclohexanone is_a: CHEBI:24693 ! hydroxycyclohexanone [Term] id: CHEBI:65030 name: 2'''-acetyl-6'''-hydroxyneomycin C(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65031 name: 6'''-hydroxyneomycin C(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65032 name: dihydrochanoclavine-I aldehyde(1+) subset: chebi_ph7_3 is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65034 name: 6,8-dimethyl-6,7-didehydroergolin-6-ium subset: chebi_ph7_3 is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:65035 name: festuclavine is_a: CHEBI:23943 ! ergot alkaloid [Term] id: CHEBI:65036 name: didehydroagroclavine subset: chebi_ph7_3 is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:65037 name: miltiradiene subset: chebi_ph7_3 is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:50072 ! abietadiene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:65040 name: UDP-2-acetamido-2-deoxy-alpha-D-glucuronate(3-) subset: chebi_ph7_3 is_a: CHEBI:58900 ! UDP-2-acetamido-2-deoxy-D-glucuronate(3-) [Term] id: CHEBI:65041 name: dihydrochanoclavine-I aldehyde is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:65042 name: agroclavine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65043 name: 6'''-hydroxyneomycin C is_a: CHEBI:47779 ! aminoglycoside [Term] id: CHEBI:65044 name: 2'''-acetyl-6'''-hydroxyneomycin C is_a: CHEBI:47779 ! aminoglycoside [Term] id: CHEBI:65045 name: festuclavine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65046 name: 2-deoxy-scyllo-inosamine is_a: CHEBI:61689 ! amino cyclitol [Term] id: CHEBI:65047 name: UDP-2-acetamido-2-deoxy-alpha-D-glucuronic acid is_a: CHEBI:52775 ! UDP-N-acetyl-2-amino-2-deoxy-D-glucuronic acid [Term] id: CHEBI:65048 name: cyclo(tyrosyl-tyrosyl) subset: chebi_ph7_3 is_a: CHEBI:65061 ! 2,5-diketopiperazines [Term] id: CHEBI:65052 name: tetracosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:65053 name: EC 4.1.1.19 (arginine decarboxylase) inhibitor is_a: CHEBI:76906 ! EC 4.1.1.* (carboxy-lyase) inhibitor [Term] id: CHEBI:65055 name: 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:65056 name: EC 3.1.3.11 (fructose-bisphosphatase) inhibitor is_a: CHEBI:76775 ! EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor [Term] id: CHEBI:65057 name: adenosine A1 receptor agonist is_a: CHEBI:73311 ! adenosine receptor agonist [Term] id: CHEBI:65059 name: docosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:65060 name: (9Z)-myristoleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:65061 name: 2,5-diketopiperazines subset: chebi_ph7_3 is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:46846 ! piperazinone [Term] id: CHEBI:65063 name: cyclo(L-tyrosyl-L-tyrosyl) subset: chebi_ph7_3 is_a: CHEBI:65048 ! cyclo(tyrosyl-tyrosyl) relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:65064 name: EC 2.1.1.79 (cyclopropane-fatty-acyl-phospholipid synthase) inhibitor is_a: CHEBI:76871 ! EC 2.1.1.* (methyltransferases) inhibitor [Term] id: CHEBI:65065 name: EC 2.1.1.72 [site-specific DNA-methyltransferase (adenine-specific)] inhibitor is_a: CHEBI:76871 ! EC 2.1.1.* (methyltransferases) inhibitor [Term] id: CHEBI:65066 name: trans,octacis-decaprenylphospho-beta-D-arabinofuranose(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65067 name: trans,octacis-decaprenylphospho-beta-D-erythro-pentofuranosid-2-ulose(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65068 name: 6'''-oxoneomycin C(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65069 name: 2-deoxystreptamine(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65070 name: carboxynorspermidine(2+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:65071 name: 2'-deamino-2'-hydroxyparomamine(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65072 name: carboxyspermidine(2+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:65073 name: C20 3-dehydrosphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84411 ! 3-dehydrosphingoid base(1+) [Term] id: CHEBI:65074 name: N-hexacosanoyl-C20-4-hydroxysphinganine subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:71985 ! C20 phytoceramide [Term] id: CHEBI:65075 name: 2'-deamino-2'-hydroxyparomamine is_a: CHEBI:22479 ! amino cyclitol glycoside [Term] id: CHEBI:65076 name: neamine(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65077 name: neomycin C(6+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65078 name: isopentenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65079 name: trans,polycis-decaprenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65080 name: N-acetyl-alpha-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65081 name: 2-oxo-3-(5-oxofuran-2-ylidene)propanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:65082 name: 5''-phosphoribostamycin(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65084 name: 2-hydroxyoctadecanal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:65085 name: butirosin B(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:65086 name: gamma-L-glutamylbutirosin B(3+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:65087 name: (9Z)-myristoleoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA [Term] id: CHEBI:65088 name: docosanoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:65089 name: Ins-1-P-Cer(d18:0/26:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:64941 ! inositol phosphodihydroceramide(1-) is_a: CHEBI:75481 ! Ins-1-P-Cer-A 44:0(1-) [Term] id: CHEBI:65090 name: 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:65091 name: Ins-1-P-Cer(d18:0/24:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:64941 ! inositol phosphodihydroceramide(1-) is_a: CHEBI:75480 ! Ins-1-P-Cer-A 42:0(1-) [Term] id: CHEBI:65092 name: 1-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:167057 ! Monolysocardiolipin(2-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:65094 name: Ins-1-P-Cer(d18:0/2-OH-26:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:64941 ! inositol phosphodihydroceramide(1-) [Term] id: CHEBI:65096 name: trans,octacis-decaprenylphospho-beta-D-arabinofuranose is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:65097 name: 2-hydroxyhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:139189 ! 2-hydroxy fatty acid anion 16:0 is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:65098 name: 6'''-oxoneomycin C is_a: CHEBI:22479 ! amino cyclitol glycoside [Term] id: CHEBI:65100 name: trans,octacis-decaprenylphospho-beta-D-erythro-pentofuranosid-2-ulose is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:65101 name: 2-hydroxyhexadecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:72726 ! hydroxypalmitic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:65102 name: 3-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:65106 name: 1-monolysocardiolipin is_a: CHEBI:17517 ! phosphatidylglycerol [Term] id: CHEBI:65107 name: N-hexadecanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:144703 ! N-palmitoyl-sphingoid base is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:65108 name: gamma-L-glutamylbutirosin B is_a: CHEBI:65109 ! butirosin relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:65109 name: butirosin is_a: CHEBI:22479 ! amino cyclitol glycoside relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:65110 name: butirosin B is_a: CHEBI:65109 ! butirosin relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:65111 name: 3-substituted propionyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:65113 name: 5''-phosphoribostamycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:37549 ! glycoside phosphate [Term] id: CHEBI:65114 name: 2-oxo-3-(5-oxofuran-2-ylidene)propanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:50523 ! butenolide [Term] id: CHEBI:65115 name: 3-oxoicosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:65116 name: N-acetyl-alpha-D-glucosaminyl-1-diphospho-trans,polycis-decaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:65117 name: CDP-N,N-dimethylethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65118 name: C20 3-dehydrosphinganine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:65119 name: 2-hydroxy-ATP is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate [Term] id: CHEBI:65121 name: isopentenyl phosphate is_a: CHEBI:25381 ! monoalkyl phosphate [Term] id: CHEBI:65122 name: 3-substituted propionyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:65129 name: 2-hydroxy-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:65131 name: (6Z,9Z,12Z,15Z,18Z,21Z)-3-oxotetracosahexaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:65132 name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:65134 name: 8-oxo-GDP is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate [Term] id: CHEBI:65135 name: 8-oxo-GMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:65136 name: (4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:61204 ! docosapentaenoic acid relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:83146 ! Daphnia tenebrosa metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:65139 name: (2E,6Z,9Z,12Z,15Z,18Z,21Z)-tetracosaheptaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:65156 name: Man-beta1-6-Ins-1-P-Cer(d18:0/24:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:139065 ! mannosylinositol-1-phosphodihydroceramide(1-) [Term] id: CHEBI:65172 name: ximelagatran subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:140326 ! tertiary carboxamide is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:37622 ! carboxamide is_a: CHEBI:38777 ! azetidines is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:65234 ! amidoxime relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:64926 ! serine protease inhibitor relationship: has_role CHEBI:65232 ! EC 3.4.21.5 (thrombin) inhibitor [Term] id: CHEBI:65173 name: iloperidone is_a: CHEBI:26151 ! piperidines is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:51545 ! 1,2-benzoxazoles is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:63534 ! monoamine is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:65191 ! second generation antipsychotic [Term] id: CHEBI:65180 name: GDP(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65190 name: first generation antipsychotic is_a: CHEBI:35476 ! antipsychotic agent [Term] id: CHEBI:65191 name: second generation antipsychotic is_a: CHEBI:35476 ! antipsychotic agent [Term] id: CHEBI:65207 name: vascular endothelial growth factor receptor antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:65210 name: (2E,6Z,9Z,12Z,15Z,18Z,21Z)-tetracosaheptaenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:65211 name: 1,2-dilauroyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:85564 ! phosphatidylcholine 24:0 is_a: CHEBI:87659 ! dodecanoate ester relationship: has_role CHEBI:65254 ! LRH-1 agonist [Term] id: CHEBI:65212 name: polysaccharide derivative is_a: CHEBI:167559 ! glycan is_a: CHEBI:33694 ! biomacromolecule is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:65213 name: 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion is_a: CHEBI:78200 ! 2-acylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:65214 name: 2-acyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:68497 ! lysophosphatidylserine(1-) is_a: CHEBI:78214 ! 2-acylglycero-3-phospho-Lserine(1-) [Term] id: CHEBI:65215 name: 1-acyl-2-alkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:68489 ! alkyl,acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:65220 name: 1-alkyl-2-acyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:68490 ! alkyl,acyl-sn-glycero-3-phospho-L-serine(1-) is_a: CHEBI:78224 ! 1-alkyl-2-acylglycero-3-phosphoserine(1-) [Term] id: CHEBI:65221 name: 1,2-dioctanoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:65228 name: 3-hydroxyphenyl propanoate subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:65232 name: EC 3.4.21.5 (thrombin) inhibitor is_a: CHEBI:5924 ! EC 3.4.21.* (serine endopeptidase) inhibitor [Term] id: CHEBI:65234 name: amidoxime is_a: CHEBI:2634 ! amidine [Term] id: CHEBI:65240 name: 1-alkyl-2-acyl-sn-glycero-3-phosphoserine is_a: CHEBI:68521 ! alkyl,acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:65243 name: 1,2-dioctanoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:65244 name: zeinoxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol [Term] id: CHEBI:65248 name: L-tyrosiniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:65249 name: L-lysiniumyl(2+) group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:65250 name: L-cysteiniumyl group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:65254 name: LRH-1 agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:65255 name: food preservative is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:65256 name: antimicrobial food preservative is_a: CHEBI:33281 ! antimicrobial agent is_a: CHEBI:65255 ! food preservative [Term] id: CHEBI:65258 name: L-pyrrolysinium is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:65259 name: GABA antagonist is_a: CHEBI:48706 ! antagonist is_a: CHEBI:51374 ! GABA agent [Term] id: CHEBI:65260 name: 3-hydroxyacyl-CoA is_a: CHEBI:62618 ! hydroxyacyl-CoA [Term] id: CHEBI:65261 name: purine deoxyribonucleotide(1-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:65262 name: pyrimidine deoxyribonucleotide(1-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:65263 name: cyclobutadithymidine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:65264 name: dodecanoyl-pantetheine-4-phosphorylserine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:65280 name: N(omega)-methyl-argininium(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:65283 name: dodecanoyl-pantetheine-4-phosphorylserine residue is_a: CHEBI:76241 ! O-(S-acylpantetheine-4'-phosphoryl)serine residue [Term] id: CHEBI:65285 name: aliphatic amide subset: chebi_ph7_3 is_a: CHEBI:33653 ! aliphatic compound is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:65286 name: L-tyrosine-O-sulfate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:65287 name: cyclobutadithymidine residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:65294 name: phosphatidylcholine 28:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:65295 name: N-alkylphthalic monoamide(1-) subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:65296 name: primary ammonium ion subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:6530 name: longifolene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene [Term] id: CHEBI:65303 name: phosphatidylcholine 30:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:65305 name: purine deoxyribonucleotide residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:65306 name: pyrimidine deoxyribonucleotide residue is_a: CHEBI:55367 ! deoxyribonucleotide residue [Term] id: CHEBI:65309 name: N(omega)-methyl-L-arginine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:65311 name: corticotropin-releasing hormone is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:25905 ! peptide hormone is_a: CHEBI:33694 ! biomacromolecule relationship: has_role CHEBI:25512 ! neurotransmitter [Term] id: CHEBI:65314 name: pseudouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:65315 name: uridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:65316 name: L-tyrosine-O-sulfate residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:65317 name: 2'-deoxynucleoside 5'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:65318 name: cyanophycin macromolecule is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:33694 ! biomacromolecule is_a: CHEBI:53224 ! poly(amide) macromolecule [Term] id: CHEBI:65320 name: pseudouridine 5'-phosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:65321 name: terpenoid indole alkaloid is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:65322 name: hemiterpenoid indole alkaloid is_a: CHEBI:65321 ! terpenoid indole alkaloid [Term] id: CHEBI:65323 name: monoterpenoid indole alkaloid is_a: CHEBI:65321 ! terpenoid indole alkaloid [Term] id: CHEBI:65327 name: D-xylose is_a: CHEBI:18222 ! xylose [Term] id: CHEBI:65328 name: L-xylose is_a: CHEBI:18222 ! xylose [Term] id: CHEBI:65331 name: alkyl caffeate ester subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33566 ! catechols is_a: CHEBI:36087 ! cinnamate ester [Term] id: CHEBI:65335 name: 3-deoxy-D-manno-octulosonate is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:65340 name: 5-formyltetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:65341 name: 5-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion [Term] id: CHEBI:65342 name: 5-oxo-ETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131859 ! oxo-ETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:65352 name: achromobactin free acid is_a: CHEBI:142734 ! N-acyl hemiaminal is_a: CHEBI:35742 ! tetracarboxylic acid relationship: has_role CHEBI:26672 ! siderophore [Term] id: CHEBI:65585 name: carnosic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33566 ! catechols is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35660 ! HIV protease inhibitor relationship: has_role CHEBI:50926 ! angiogenesis modulating agent relationship: has_role CHEBI:65255 ! food preservative relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6570 name: lupeol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6572 name: L-lupinic acid is_a: CHEBI:30885 ! lupinic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:65737 name: demethoxycurcumin subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:51689 ! enone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:78802 ! diarylheptanoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:6574 name: lupulone is_a: CHEBI:136848 ! beta-bitter acid relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:65768 name: (9Z,12Z,15Z)-octadeca-9,12,15-trien-6-ynoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25380 ! acetylenic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor [Term] id: CHEBI:65932 name: funalenone is_a: CHEBI:33853 ! phenols is_a: CHEBI:51689 ! enone is_a: CHEBI:51959 ! organic tricyclic compound relationship: has_role CHEBI:67189 ! EC 3.4.24.3 (microbial collagenase) inhibitor relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:6618 name: Met-enkephalin is_a: CHEBI:48545 ! pentapeptide relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:55322 ! mu-opioid receptor agonist relationship: has_role CHEBI:64054 ! delta-opioid receptor agonist relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:66331 name: xanthohumol is_a: CHEBI:23086 ! chalcones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:64919 ! EC 2.3.1.20 (diacylglycerol O-acyltransferase) inhibitor relationship: has_role CHEBI:64947 ! anti-HIV-1 agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:6641 name: (S)-magnoflorine subset: chebi_ph7_3 is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:66470 name: (+)-sesamin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:47790 ! furofuran relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6650 name: malic acid is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid relationship: has_role CHEBI:64049 ! food acidity regulator relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:66848 name: phosphatidylcholine 32:2 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66849 name: phosphatidylcholine 32:1 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66850 name: phosphatidylcholine 32:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66855 name: phosphatidylcholine 34:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66856 name: phosphatidylcholine 36:6 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66857 name: phosphatidylcholine 36:1 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66858 name: phosphatidylcholine 36:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66862 name: phosphatidylcholine 40:4 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66867 name: trans,polycis-decaprenyl phosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:66868 name: carboxyspermidine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:66873 name: C4-dicarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:66874 name: carnosinate is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:66878 name: pseudooxynicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:66879 name: 4-oxo-4-(pyridin-3-yl)butanal subset: chebi_ph7_3 is_a: CHEBI:22939 ! butanals is_a: CHEBI:26421 ! pyridines is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:66881 name: trans,octacis-decaprenylphospho-beta-D-ribofuranose(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:66882 name: 4-(methylamino)butyric acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:66884 name: N-alkylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:66887 name: (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:19615 ! 2-hydroxy-6-oxonona-2,4-dienedioate [Term] id: CHEBI:66888 name: (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:58637 ! 2-hydroxy-6-oxonona-2,4,7-trienedioate [Term] id: CHEBI:66893 name: 4-(6-hydroxypyridin-3-yl)-4-oxobutyrate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:66896 name: (+)-5-oxo-1,2-campholide subset: chebi_ph7_3 is_a: CHEBI:66953 ! 5-oxo-1,2-campholide [Term] id: CHEBI:66898 name: (3R)-11-cis-3-hydroxyretinal subset: chebi_ph7_3 is_a: CHEBI:26534 ! retinals [Term] id: CHEBI:669 name: 1-phenylethanol subset: chebi_ph7_3 is_a: CHEBI:33854 ! aromatic alcohol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:66904 name: 2',3,4,4',6'-pentahydroxychalcone 4'-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:66905 name: aureusidin 6-O-beta-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:85970 ! hydroxyaurone [Term] id: CHEBI:66906 name: 2',4,4',6'-tetrahydroxychalcone 4'-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:66907 name: bracteatin 6-O-beta-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:66909 name: alpha-D-Glcp-(1->3)-L-Rhap subset: chebi_ph7_3 is_a: CHEBI:55333 ! glycosylrhamnose [Term] id: CHEBI:66911 name: alpha-D-mannosyl-(1->4)-alpha-L-rhamnosyl-(1->3)-beta-D-galactosyl-1-diphosphodecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:66912 name: alpha-D-abequosyl-(1->3)-alpha-D-mannosyl-(1->4)-alpha-L-rhamnosyl-(1->3)-beta-D-galactosyl-1-diphosphodecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:66914 name: UDP-alpha-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:140359 ! UDP-monosaccharide(2-) is_a: CHEBI:58439 ! UDP-D-galactose(2-) [Term] id: CHEBI:66915 name: UDP-alpha-D-galactofuranose(2-) subset: chebi_ph7_3 is_a: CHEBI:58423 ! UDP-D-galactofuranose(2-) [Term] id: CHEBI:66916 name: alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:66918 name: ergosta-5,7-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50403 ! ergostanoid [Term] id: CHEBI:66922 name: citrullinate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:66924 name: creatinate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:66929 name: trans,octacis-decaprenylphospho-beta-D-ribofuranose is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:66933 name: N-alkylglycine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:66934 name: cyanoamino acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:66936 name: (2Z,4E)-2-hydroxy-6-oxonona-2,4-dienedioic acid is_a: CHEBI:17367 ! 2-hydroxy-6-oxonona-2,4-dienedioic acid [Term] id: CHEBI:66937 name: trans,octacis-decaprenylphospho-beta-D-ribofuranose 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:66938 name: keto-D-gluconic acid is_a: CHEBI:24967 ! ketogluconic acid [Term] id: CHEBI:66939 name: (2Z,4E,7E)-2-hydroxy-6-oxonona-2,4,7-trienedioic acid is_a: CHEBI:31082 ! 2-hydroxy-6-oxonona-2,4,7-trienedioic acid [Term] id: CHEBI:66940 name: fructosylglycinate is_a: CHEBI:63790 ! glyco-amino-acid anion [Term] id: CHEBI:66941 name: ecgononium methyl ester(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:66942 name: 4-oxo-4-(pyridin-3-yl)butanoate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:66944 name: 2,6-dihydroxypseudooxynicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:66945 name: 4-nitro-6-oxohepta-2,4-dienedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:66946 name: 4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:66947 name: (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion [Term] id: CHEBI:66948 name: isoglutamate(1-) subset: chebi_ph7_3 is_a: CHEBI:49095 ! beta-amino-acid anion [Term] id: CHEBI:66949 name: nucleoside 3'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:6695 name: (+)-marmesin subset: chebi_ph7_3 is_a: CHEBI:49080 ! marmesin [Term] id: CHEBI:66950 name: olivetolate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:66951 name: 4-oxo-4-(pyridin-3-yl)butanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26421 ! pyridines is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:66952 name: homocysteinate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:66953 name: 5-oxo-1,2-campholide subset: chebi_ph7_3 is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:50361 ! ketolactone [Term] id: CHEBI:66954 name: 2',3'-cyclic nucleotide(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:66955 name: olivetolic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66956 name: antidyskinesia agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:66957 name: 3,5,7-trioxododecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:61903 ! oxo-fatty acyl-CoA is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:66958 name: 4-hydroxy-6-pentylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:75885 ! 2-pyranones relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:66960 name: olivetol subset: chebi_ph7_3 is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:78361 ! lichen metabolite [Term] id: CHEBI:66961 name: cannabinerolate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:66962 name: cannabigerolate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:66963 name: Delta(9)-tetrahydrocannabinolate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:66964 name: Delta(9)-tetrahydrocannabinol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:38920 ! benzochromene is_a: CHEBI:67196 ! phytocannabinoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35481 ! non-narcotic analgesic relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:53000 ! epitope relationship: has_role CHEBI:67072 ! cannabinoid receptor agonist [Term] id: CHEBI:6698 name: (-)-matairesinol subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37581 ! gamma-lactone relationship: has_role CHEBI:48422 ! angiogenesis inhibitor relationship: has_role CHEBI:65023 ! anti-asthmatic agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:66980 name: nootropic agent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:66981 name: ophthalmology drug is_a: CHEBI:23888 ! drug [Term] id: CHEBI:66982 name: mycophenolic acid O-acyl-glucuronide(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:66987 name: radiation protective agent is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:66993 name: tocolytic agent is_a: CHEBI:50689 ! reproductive control drug [Term] id: CHEBI:66998 name: histidinate derivative is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:67001 name: hypusinate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:67008 name: kynureninate is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:67009 name: S-adenosyl-L-homocysteinate is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:67010 name: L-kynureninate is_a: CHEBI:59814 ! L-alpha-amino acid anion is_a: CHEBI:67008 ! kynureninate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:67011 name: folates is_a: CHEBI:176842 ! vitamin B9 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:67012 name: L-dopa(1-) is_a: CHEBI:59814 ! L-alpha-amino acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:67013 name: methyl-branched fatty acid anion is_a: CHEBI:58955 ! branched-chain fatty acid anion [Term] id: CHEBI:67014 name: dihydrofolates is_a: CHEBI:67011 ! folates [Term] id: CHEBI:67015 name: N(omega)-methyl-L-argininate is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:67016 name: tetrahydrofolate is_a: CHEBI:67011 ! folates [Term] id: CHEBI:67021 name: N-docosanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:67022 name: lipoxin anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:67023 name: N-(2-hydroxydocosanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:67026 name: lipoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:67022 ! lipoxin anion [Term] id: CHEBI:67027 name: N-eicosanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:67031 name: lipoxin B4(1-) subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:67022 ! lipoxin anion [Term] id: CHEBI:67032 name: O-phosphonatooxyserine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67033 name: N-octodecanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:144711 ! N-stearoyl-sphingoid base is_a: CHEBI:31488 ! N-acylsphinganine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:67034 name: N-(2-hydroxyoctadecanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:67035 name: N-octadecanoyl-4-hydroxysphinganine subset: chebi_ph7_3 is_a: CHEBI:144711 ! N-stearoyl-sphingoid base is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:67036 name: O-(N-acetylglucosamine-1-phosphonatooxy)-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67037 name: D-octopine(1-) is_a: CHEBI:60895 ! D-alpha-amino acid anion [Term] id: CHEBI:67039 name: prenylcysteinate is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:67040 name: S-adenosyl-L-methioninate is_a: CHEBI:35282 ! sulfonium betaine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:67042 name: N-hexadecanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:137568 ! Cer(d34:0) is_a: CHEBI:144703 ! N-palmitoyl-sphingoid base is_a: CHEBI:31488 ! N-acylsphinganine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:67043 name: N-(2-hydroxyhexadecanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:67045 name: N-tetradecanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:67049 name: N(alpha),N(alpha),N(alpha)-trimethyl-L-histidinium(1+) is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:67050 name: S-methyl-L-methioninate is_a: CHEBI:25268 ! methyl-L-methionine is_a: CHEBI:35282 ! sulfonium betaine [Term] id: CHEBI:67051 name: phosphopantetheine anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67052 name: glyphosate(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67058 name: lysophosphatidylcholine 20:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67062 name: lipo-chitin oligosaccharide is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:67063 name: poly-beta-1,6-N-acetyl-D-glucosamine is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:67064 name: phosphatidylcholine O-36:4 subset: chebi_ph7_3 is_a: CHEBI:68489 ! alkyl,acyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67072 name: cannabinoid receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:67078 name: Delta(9)-tetrahydrocannabinolic acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:38920 ! benzochromene is_a: CHEBI:67196 ! phytocannabinoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:67079 name: anti-inflammatory agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:67080 name: cannabinerolic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:67196 ! phytocannabinoid [Term] id: CHEBI:67081 name: cannabigerolic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:67196 ! phytocannabinoid [Term] id: CHEBI:67089 name: 3,5,7-trioxododecanoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:67090 name: N-acylsphinganine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin is_a: CHEBI:82829 ! sphinganine-based sphingolipid [Term] id: CHEBI:67103 name: (2E,4Z)-4-hydroxy-6-oxohexa-2,4-dienoic acid is_a: CHEBI:145078 ! 3-oxo aldehyde is_a: CHEBI:38436 ! muconic semialdehyde [Term] id: CHEBI:67104 name: 4-nitro-6-oxohepta-2,4-dienedioic acid is_a: CHEBI:17087 ! ketone is_a: CHEBI:35716 ! C-nitro compound is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:67106 name: 1-deoxysphinganine is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:35785 ! sphingoid relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:67108 name: 1-deoxymethylsphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:132044 ! Deoxymethylsphingoid base is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:67109 name: 1-deoxysphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:132046 ! Deoxysphingoid base is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:67114 name: ryanodine receptor agonist is_a: CHEBI:38809 ! ryanodine receptor modulator [Term] id: CHEBI:67115 name: ecgonone methyl ester is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:37332 ! tropane alkaloid is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:67117 name: trans,octacis-decaprenylphospho-beta-D-ribofuranose 5-phosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67118 name: UDP-alpha-D-galactofuranose is_a: CHEBI:18251 ! UDP-D-galactofuranose [Term] id: CHEBI:67119 name: UDP-alpha-D-galactose is_a: CHEBI:18307 ! UDP-D-galactose relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:67122 name: alpha-D-abequosyl-(1->3)-alpha-D-mannosyl-(1->4)-alpha-L-rhamnosyl-(1->3)-beta-D-galactosyl-1-diphosphodecaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67124 name: alpha-D-mannosyl-(1->4)-alpha-L-rhamnosyl-(1->3)-beta-D-galactosyl-1-diphosphodecaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67132 name: ditrans,polycis-polyprenol subset: chebi_ph7_3 is_a: CHEBI:26199 ! polyprenol [Term] id: CHEBI:67133 name: UDP-2-acetamido-4-azaniumyl-2,4,6-trideoxy-alpha-D-glucose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:67134 name: UDP-N,N'-diacetylbacillosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:67135 name: 2-nitroimidazole subset: chebi_ph7_3 is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:35716 ! C-nitro compound relationship: has_role CHEBI:33231 ! antitubercular agent [Term] id: CHEBI:67136 name: cannabidiolate subset: chebi_ph7_3 is_a: CHEBI:36084 ! dihydroxybenzoate [Term] id: CHEBI:67138 name: UDP-N-acetyl-alpha-D-galactosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:140359 ! UDP-monosaccharide(2-) is_a: CHEBI:57847 ! UDP-N-acetyl-D-galactosamine(2-) [Term] id: CHEBI:67139 name: (2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:6714 name: (+)-medicarpin subset: chebi_ph7_3 is_a: CHEBI:16114 ! medicarpin [Term] id: CHEBI:67140 name: phosphate monoester dianion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67142 name: nucleobase analogue is_a: CHEBI:33832 ! organic cyclic compound [Term] id: CHEBI:67143 name: pppA2'p5'A2'p5'A subset: chebi_ph7_3 is_a: CHEBI:7754 ! oligonucleotide relationship: has_role CHEBI:48001 ! protein synthesis inhibitor [Term] id: CHEBI:67145 name: fumigaclavine A(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:67146 name: fumigaclavine B(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:67147 name: fumigaclavine C(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:67148 name: 2-hydroxybenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:67150 name: beta-D-Glc-(1->3')-1,2-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:67152 name: (2Z)-2-hydroxypenta-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:37319 ! 2-hydroxypenta-2,4-dienoate [Term] id: CHEBI:67153 name: (+)-larreatricin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:26912 ! oxolanes is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67154 name: (+)-3'-hydroxylarreatricin subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:26912 ! oxolanes relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67156 name: fumigaclavine B is_a: CHEBI:23943 ! ergot alkaloid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67158 name: (R)-3-ammonio-3-phenylpropanoate subset: chebi_ph7_3 is_a: CHEBI:68527 ! 3-ammonio-3-phenylpropanoate [Term] id: CHEBI:67159 name: fumigaclavine A is_a: CHEBI:23943 ! ergot alkaloid is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67168 name: UDP-N-acetyl-alpha-D-galactosamine is_a: CHEBI:16650 ! UDP-N-acetyl-D-galactosamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:67172 name: (R)-3-amino-3-phenylpropanoic acid is_a: CHEBI:68528 ! 3-amino-3-phenylpropanoic acid [Term] id: CHEBI:67176 name: 1-deoxy-3-dehydrosphinganine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:67177 name: 1-deoxymethyl-3-dehydrosphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:132044 ! Deoxymethylsphingoid base is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:67178 name: UDP-N,N'-diacetylbacillosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:67182 name: sporulenol subset: chebi_ph7_3 is_a: CHEBI:51961 ! sesquarterpenoid [Term] id: CHEBI:67186 name: 1-deoxymethyl-3-dehydrosphinganine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:67187 name: 1-deoxymethylsphinganine is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:67188 name: 9-cis-beta-carotene subset: chebi_ph7_3 is_a: CHEBI:23044 ! carotenoid relationship: has_role CHEBI:26130 ! biological pigment [Term] id: CHEBI:67189 name: EC 3.4.24.3 (microbial collagenase) inhibitor is_a: CHEBI:59107 ! EC 3.4.24.* (metalloendopeptidase) inhibitor [Term] id: CHEBI:67190 name: carlactone subset: chebi_ph7_3 is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:37848 ! plant hormone [Term] id: CHEBI:67191 name: (2E,4E,6E)-7-hydroxy-4-methylhepta-2,4,6-trienal subset: chebi_ph7_3 is_a: CHEBI:50413 ! hydroxyaldehyde is_a: CHEBI:51688 ! enal [Term] id: CHEBI:67192 name: 9-cis-10'-apo-beta-carotenal subset: chebi_ph7_3 is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:67193 name: 4-methylheptane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67194 name: cannabinoid is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:67072 ! cannabinoid receptor agonist [Term] id: CHEBI:67195 name: gap junctional intercellular communication inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:67196 name: phytocannabinoid is_a: CHEBI:67194 ! cannabinoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67197 name: endocannabinoid is_a: CHEBI:18059 ! lipid is_a: CHEBI:67194 ! cannabinoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67198 name: retinoic acid receptor agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:90708 ! retinoic acid receptor modulator [Term] id: CHEBI:67199 name: AP-1 antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:67200 name: provitamin A is_a: CHEBI:50188 ! provitamin [Term] id: CHEBI:67201 name: synthetic cannabinoid is_a: CHEBI:67194 ! cannabinoid [Term] id: CHEBI:67204 name: carboxynorspermidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:67205 name: (2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:67208 name: double-stranded RNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:67209 name: alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67210 name: beta-D-Galf-(1->5)-beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67211 name: beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67212 name: [beta-D-Galf-(1->5)-beta-D-Galf-(1->6)]14-beta-D-Galf-(1->5)-beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:67213 name: 2'-deamino-2'-hydroxyneamine(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:67214 name: 2'-deamino-2'-hydroxy-6'-dehydroparomamine(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:67223 name: 2'-deamino-2'-hydroxyneamine is_a: CHEBI:22479 ! amino cyclitol glycoside relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:67225 name: 2'-deamino-2'-hydroxy-6'-dehydroparomamine is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:22479 ! amino cyclitol glycoside [Term] id: CHEBI:67227 name: beta-carotene 15,15'-epoxide subset: chebi_ph7_3 is_a: CHEBI:23043 ! epoxycarotenoid [Term] id: CHEBI:67228 name: 15,15'-dihydroxy-beta-carotene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol [Term] id: CHEBI:67237 name: (22R)-22-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:67239 name: EC 3.2.1.20 (alpha-glucosidase) inhibitor is_a: CHEBI:52424 ! EC 3.2.1.* (glycosidase) inhibitor [Term] id: CHEBI:67241 name: beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67244 name: (-)-lariciresinol subset: chebi_ph7_3 is_a: CHEBI:25036 ! lignan is_a: CHEBI:26912 ! oxolanes is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:67245 name: (-)-pinoresinol subset: chebi_ph7_3 is_a: CHEBI:8225 ! pinoresinol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67246 name: (+)-lariciresinol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:25036 ! lignan is_a: CHEBI:26912 ! oxolanes is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67247 name: (+)-secoisolariciresinol subset: chebi_ph7_3 is_a: CHEBI:67250 ! secoisolariciresinol [Term] id: CHEBI:67248 name: 4-(3-methylbut-2-enyl)-L-abrine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:67250 name: secoisolariciresinol is_a: CHEBI:22944 ! butanediols is_a: CHEBI:25036 ! lignan is_a: CHEBI:26195 ! polyphenol [Term] id: CHEBI:67253 name: alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67256 name: beta-D-Galf-(1->5)-beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:67260 name: geranate subset: chebi_ph7_3 is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:67261 name: (Z)-2,3-dehydroadipyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:67262 name: dihydrocurcumin subset: chebi_ph7_3 is_a: CHEBI:176657 ! 1,7-bis(4-hydroxy-3-methoxyphenyl)hept-1-ene-3,5-dione [Term] id: CHEBI:67263 name: tetrahydrocurcumin subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:78802 ! diarylheptanoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:67264 name: geranic acid is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:64933 ! melanin synthesis inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67265 name: beta-diketone is_a: CHEBI:46640 ! diketone [Term] id: CHEBI:67269 name: cyclo(L-leucyl-L-leucyl) subset: chebi_ph7_3 is_a: CHEBI:65061 ! 2,5-diketopiperazines [Term] id: CHEBI:67273 name: monohydroxy-1,4-benzoquinones subset: chebi_ph7_3 is_a: CHEBI:132124 ! 1,4-benzoquinones is_a: CHEBI:33823 ! enol is_a: CHEBI:71648 ! hydroxybenzoquinone [Term] id: CHEBI:67274 name: lysophosphatidylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion is_a: CHEBI:78201 ! monoacylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:67347 name: (+)-pisatin subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:26115 ! phytoalexin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67375 name: noreugenin is_a: CHEBI:23238 ! chromones is_a: CHEBI:33572 ! resorcinols relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6746 name: menadiol subset: chebi_ph7_3 is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:25324 ! methylnaphthalenes is_a: CHEBI:51475 ! naphthohydroquinone [Term] id: CHEBI:6750 name: (+)-menthofuran subset: chebi_ph7_3 is_a: CHEBI:50542 ! menthofuran [Term] id: CHEBI:67554 name: daucosterol subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67931 name: petiolaroside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:64621 ! quercetin O-glucoside relationship: has_role CHEBI:36335 ! trypanocidal drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67939 name: erythrodiol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23824 ! diol is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67987 name: ginsenoside Rg1 subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:72571 ! pro-angiogenic agent [Term] id: CHEBI:67988 name: ginsenoside Rd subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67989 name: ginsenoside Rb1 subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:74518 ! anti-obesity agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:67991 name: (20S)-ginsenoside Rg3 subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50926 ! angiogenesis modulating agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:6801 name: metformin is_a: CHEBI:24436 ! guanidines relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:6809 name: methamphetamine is_a: CHEBI:32863 ! secondary amine is_a: CHEBI:35338 ! amphetamines relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:68352 name: quercetin 3-O-beta-D-glucopyranoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:38684 ! tetrahydroxyflavone is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:64621 ! quercetin O-glucoside relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:37956 ! histamine antagonist relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:59683 ! antipruritic drug relationship: has_role CHEBI:63054 ! osteogenesis regulator relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:68383 name: stigmasterol 3-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26125 ! phytosterols is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68437 name: 5,6,7,8-tetrahydrofolate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:67016 ! tetrahydrofolate [Term] id: CHEBI:68438 name: Fe-coproporphyrin III(4-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:68448 name: beta-D-GalpNAc-(1->4)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:61190 ! beta-D-GalpNAc-(1->4)-D-GlcpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:68452 name: azole is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38179 ! monocyclic heteroarene [Term] id: CHEBI:68458 name: multi-methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:68464 name: 4-(3-methylbut-2-enyl)-L-abrine is_a: CHEBI:21752 ! N-methyl-L-alpha-amino acid is_a: CHEBI:47994 ! L-tryptophan derivative [Term] id: CHEBI:68465 name: 2,6-dihydroxybenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68471 name: (Z)-2,3-dehydroadipoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27803 ! cis-2-enoyl-CoA [Term] id: CHEBI:68472 name: pyrimidine deoxyribonucleoside is_a: CHEBI:23636 ! deoxyribonucleoside is_a: CHEBI:26440 ! pyrimidine nucleoside [Term] id: CHEBI:68481 name: mTOR inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor [Term] id: CHEBI:68483 name: UDP-N-acetyl-3-O-(1-carboxylatovinyl)-alpha-D-glucosamine(3-) subset: chebi_ph7_3 is_a: CHEBI:57771 ! UDP-N-acetyl-3-O-(1-carboxylatovinyl)-D-glucosamine(3-) [Term] id: CHEBI:68485 name: alpha-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-Glcp subset: chebi_ph7_3 is_a: CHEBI:60948 ! alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-D-Glc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:68487 name: strigolactone is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:50523 ! butenolide relationship: has_role CHEBI:37848 ! plant hormone [Term] id: CHEBI:68488 name: alkyl,acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:68489 name: alkyl,acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine is_a: CHEBI:78189 ! alkylacylglycero-3-phosphocholine [Term] id: CHEBI:68490 name: alkyl,acyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:78225 ! alkyl,acylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:68492 name: dTDP-4-amino-4,6-dideoxy-alpha-D-galactose(1-) subset: chebi_ph7_3 is_a: CHEBI:57596 ! dTDP-4-amino-4,6-dideoxy-D-galactose(1-) [Term] id: CHEBI:68493 name: dTDP-4-acetamido-4,6-dideoxy-alpha-D-galactose(2-) subset: chebi_ph7_3 is_a: CHEBI:61562 ! dTDP-4-acetamido-4,6-dideoxy-D-galactose(2-) [Term] id: CHEBI:68494 name: apoptosis inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:68495 name: apoptosis inducer is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:68497 name: lysophosphatidylserine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:78221 ! monoacylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:68498 name: lysophosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:78234 ! monoacylglycero-3-phospho-1-inositol(1-) [Term] id: CHEBI:685 name: 1-organyl-2-acetyl-sn-glycero-3-phospholipid(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:68501 name: dTDP-4-amino-4,6-dideoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:57582 ! dTDP-4-amino-4,6-dideoxy-D-glucose(1-) [Term] id: CHEBI:68506 name: (S)-3-ammonio-3-phenylpropanoate subset: chebi_ph7_3 is_a: CHEBI:68527 ! 3-ammonio-3-phenylpropanoate [Term] id: CHEBI:68507 name: UDP-N-acetyl-3-O-(1-carboxyvinyl)-alpha-D-glucosamine is_a: CHEBI:16435 ! UDP-N-acetyl-3-O-(1-carboxyvinyl)-D-glucosamine [Term] id: CHEBI:68508 name: diethyl maleate subset: chebi_ph7_3 is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:35486 ! maleate ester relationship: has_role CHEBI:68509 ! glutathione depleting agent [Term] id: CHEBI:68509 name: glutathione depleting agent is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:68510 name: lysophosphatidylserine is_a: CHEBI:52565 ! acylglycerophosphoserine [Term] id: CHEBI:68516 name: dTDP-4-amino-4,6-dideoxy-alpha-D-galactose is_a: CHEBI:15972 ! dTDP-4-amino-4,6-dideoxy-D-galactose [Term] id: CHEBI:68518 name: dTDP-4-acetamido-4,6-dideoxy-alpha-D-galactose is_a: CHEBI:61661 ! dTDP-4-acetamido-4,6-dideoxy-D-galactose [Term] id: CHEBI:68520 name: alkyl,acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36314 ! glycerophosphoethanolamine [Term] id: CHEBI:68521 name: alkyl,acyl-sn-glycero-3-phosphoserine is_a: CHEBI:35766 ! glycerophosphoserine [Term] id: CHEBI:68523 name: dTDP-4-amino-4,6-dideoxy-alpha-D-glucose is_a: CHEBI:15952 ! dTDP-4-amino-4,6-dideoxy-D-glucose [Term] id: CHEBI:68525 name: (S)-3-amino-3-phenylpropanoic acid is_a: CHEBI:68528 ! 3-amino-3-phenylpropanoic acid [Term] id: CHEBI:68527 name: 3-ammonio-3-phenylpropanoate subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:68528 name: 3-amino-3-phenylpropanoic acid is_a: CHEBI:33706 ! beta-amino acid [Term] id: CHEBI:68530 name: [beta-D-Galf-(1->5)-beta-D-Galf-(1->6)]14-beta-D-Galf-(1->5)-beta-D-Galf-(1->4)-alpha-L-Rhap-(1->3)-alpha-D-GlcpNAc-1-diphospho-trans,octacis-decaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:68546 name: phosphate group(2-) subset: chebi_ph7_3 is_a: CHEBI:64776 ! inorganic anionic group [Term] id: CHEBI:68549 name: diphosphate group(3-) subset: chebi_ph7_3 is_a: CHEBI:64776 ! inorganic anionic group [Term] id: CHEBI:68560 name: UDP-N-acetyl-6-(alpha-D-galactose-1-phosphonato)-alpha-D-glucosamine(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:68563 name: P2Y12 receptor antagonist is_a: CHEBI:91079 ! purinergic receptor P2 antagonist [Term] id: CHEBI:68576 name: dTDP-6-deoxy-beta-L-talose(2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:58099 ! dTDP-6-deoxy-L-talose(2-) [Term] id: CHEBI:68588 name: germacrane sesquiterpenoid is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:68607 name: steroid phosphate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68612 name: EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor is_a: CHEBI:76788 ! EC 3.4.14.* (dipeptidyl- and tripeptidyl-peptidases) inhibitor [Term] id: CHEBI:68623 name: UDP-N-acetyl-alpha-D-mannosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:57715 ! UDP-N-acetyl-D-mannosamine(2-) [Term] id: CHEBI:68624 name: cis-abienol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68625 name: valerena-4,7(11)-diene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68636 name: p-hydroxyphenylbut-3-ene-2-one subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:51689 ! enone [Term] id: CHEBI:68645 name: 2,4-diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose subset: chebi_ph7_3 is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63349 ! trideoxyhexose derivative [Term] id: CHEBI:68649 name: pentalenate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:68650 name: 1-deoxypentalenate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:68651 name: alpha-D-GalNAc-(1->4)-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68652 name: N-acetyl-alpha-D-galactosaminyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68653 name: [alpha-D-GalNAc-(1->4)]4-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68654 name: [alpha-D-GalNAc-(1->4)]2-[beta-D-Glc-(1->3)]-[alpha-D-GalNAc-(1->4)]2-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68655 name: Delta(6)-protoilludene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:68658 name: (+)-epi-alpha-bisabolol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid [Term] id: CHEBI:68665 name: pentalenic acid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68666 name: (-)-alpha-isocomene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:68667 name: (E)-2-epi-beta-caryophyllene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene is_a: CHEBI:35428 ! ortho-fused bicyclic hydrocarbon relationship: has_role CHEBI:27311 ! volatile oil component [Term] id: CHEBI:68668 name: legionaminate(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:68669 name: N,N-diacetyllegionaminate subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:68670 name: CMP-N,N-diacetyllegionaminate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:68671 name: CMP-N-acyl-beta-neuraminate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:68672 name: N,N'-diacetyl-alpha-D-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68675 name: dTDP-4-acetamido-4,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:61383 ! dTDP-4-acetamido-4,6-dideoxy-D-glucose(2-) [Term] id: CHEBI:68676 name: legionaminic acid is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63394 ! ketoaldonic acid derivative [Term] id: CHEBI:68677 name: dTDP-4-acetamido-4,6-dideoxy-alpha-D-glucose is_a: CHEBI:28294 ! dTDP-4-acetamido-4,6-dideoxy-D-glucose [Term] id: CHEBI:68678 name: UDP-N-acetyl-alpha-D-mannosamine is_a: CHEBI:16287 ! UDP-N-acetyl-D-mannosamine [Term] id: CHEBI:68679 name: dTDP-6-deoxy-beta-L-talose is_a: CHEBI:17307 ! dTDP-6-deoxy-L-talose [Term] id: CHEBI:68681 name: UDP-N-acetyl-6-(alpha-D-galactose-1-phospho)-alpha-D-glucosamine is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:68682 name: N,N-diacetyllegionaminic acid is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63394 ! ketoaldonic acid derivative [Term] id: CHEBI:68683 name: CMP-N,N-diacetyllegionaminic acid is_a: CHEBI:20878 ! CMP-sugar [Term] id: CHEBI:68684 name: methylphosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:68685 name: alpha-D-ribose 1-methylphosphonate 5-triphosphate(4-) is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:68686 name: alpha-D-ribose 1-methylphosphonate 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:68687 name: 5-phosphonato-alpha-D-ribose cyclic-1,2-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:68688 name: alpha-D-ribose 1,5-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58345 ! D-ribose 1,5-bisphosphate(4-) [Term] id: CHEBI:68689 name: 5-phospho-alpha-D-ribose cyclic-1,2-phosphate is_a: CHEBI:35158 ! ribose bisphosphate [Term] id: CHEBI:6877 name: trans-isomethyleugenol subset: chebi_ph7_3 is_a: CHEBI:14469 ! isomethyleugenol [Term] id: CHEBI:68819 name: alpha-D-ribose 1,5-bisphosphate is_a: CHEBI:17994 ! D-ribose 1,5-bisphosphate [Term] id: CHEBI:68820 name: alpha-D-ribose 1-methylphosphonate 5-phosphate is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:37592 ! organic phosphonate [Term] id: CHEBI:68822 name: methylphosphonate(2-) is_a: CHEBI:71285 ! organophosphonate(2-) [Term] id: CHEBI:68823 name: alpha-D-ribose 1-methylphosphonate 5-triphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:68824 name: alpha-D-ribose 1-methylphosphonate 5-triphosphate is_a: CHEBI:26563 ! ribose triphosphate is_a: CHEBI:37592 ! organic phosphonate [Term] id: CHEBI:68825 name: N,N'-diacetyl-alpha-D-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:68826 name: N-acetyl-alpha-D-galactosaminyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-tritrans,heptacis-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:68827 name: alpha-D-GalNAc-(1->4)-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:68828 name: 1-deoxy-3-dehydrosphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:132046 ! Deoxysphingoid base is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:68829 name: [alpha-D-GalNAc-(1->4)]4-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:68830 name: O-decanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine is_a: CHEBI:87658 ! decanoate ester relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:68831 name: [alpha-D-GalNAc-(1->4)]2-[beta-D-Glc-(1->3)]-[alpha-D-GalNAc-(1->4)]2-alpha-D-GalNAc-(1->3)-alpha-D-diNAcBac-tritrans,heptacis-undecaprenyl diphosphate is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:68832 name: 1-deoxypentalenic acid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68836 name: diphosphate group is_a: CHEBI:33246 ! inorganic group [Term] id: CHEBI:68837 name: pectate subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:68851 name: poly(glycerol phosphate) anion subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:61469 ! polyanionic polymer relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:6887 name: methylphenidate is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:51857 ! methyl (S)-phenyl[(S)-piperidin-2-yl]acetate relationship: has_part CHEBI:51860 ! dexmethylphenidate relationship: has_role CHEBI:35337 ! central nervous system stimulant relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:35524 ! sympathomimetic agent relationship: has_role CHEBI:35640 ! adrenergic uptake inhibitor relationship: has_role CHEBI:37962 ! adrenergic agent relationship: has_role CHEBI:51039 ! dopamine uptake inhibitor [Term] id: CHEBI:68946 name: alpha-dimorphecolic acid is_a: CHEBI:25627 ! octadecadienoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:68947 name: 13-oxo-9Z,11E-ODE is_a: CHEBI:136531 ! 13-oxo-9,11-octadecadienoic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:69042 name: 7-demethylsuberosin subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:69080 name: methyl linoleate subset: chebi_ph7_3 is_a: CHEBI:4986 ! fatty acid methyl ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:69081 name: 1-monopalmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134127 ! 1-acylglycerol 16:0 relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:691622 name: 1,3,7-trimethyluric acid subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:6923 name: miconazole is_a: CHEBI:60911 ! racemate is_a: CHEBI:87069 ! imidazole antifungal drug is_a: CHEBI:87071 ! conazole antifungal drug relationship: has_part CHEBI:82894 ! (R)-miconazole relationship: has_part CHEBI:82897 ! (S)-miconazole relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:75282 ! ergosterol biosynthesis inhibitor relationship: has_role CHEBI:82891 ! glucocorticoid receptor antagonist [Term] id: CHEBI:69403 name: carbonarone A subset: chebi_ph7_3 is_a: CHEBI:131906 ! 4-pyranones is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:69404 name: pestalamide A is_a: CHEBI:131906 ! 4-pyranones is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35356 ! dicarboximide relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:69579 name: hederagenin is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:26606 ! sapogenin is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:7 name: (+)-car-3-ene subset: chebi_ph7_3 is_a: CHEBI:35661 ! car-3-ene [Term] id: CHEBI:70031 name: 2'-hydroxygenistein is_a: CHEBI:38755 ! hydroxyisoflavone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:70231 name: phenazine-1,6-dicarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:7027 name: 2-amino-3-O-[(R)-1-carboxyethyl]-2-deoxy-D-glucopyranose is_a: CHEBI:28118 ! muramic acid [Term] id: CHEBI:70315 name: eburicol subset: chebi_ph7_3 is_a: CHEBI:138029 ! 14alpha-methyl steroid is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:70399 name: meleagrine subset: chebi_ph7_3 is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:24995 ! lactam is_a: CHEBI:33823 ! enol is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:70709 name: progesterone receptor agonist is_a: CHEBI:51060 ! hormone agonist [Term] id: CHEBI:70712 name: (5Z)-tetradecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:70716 name: cis-tetradec-5-enoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:36004 ! tetradecenoic acid [Term] id: CHEBI:70722 name: EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor is_a: CHEBI:76824 ! EC 6.4.1.* (carboxylase) inhibitor [Term] id: CHEBI:70723 name: reversine subset: chebi_ph7_3 is_a: CHEBI:26401 ! purines is_a: CHEBI:38785 ! morpholines is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:70724 ! cell dedifferentiation agent relationship: has_role CHEBI:70725 ! adenosine A3 receptor antagonist relationship: has_role CHEBI:70770 ! Aurora kinase inhibitor [Term] id: CHEBI:70724 name: cell dedifferentiation agent is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:70725 name: adenosine A3 receptor antagonist is_a: CHEBI:71232 ! adenosine receptor antagonist [Term] id: CHEBI:70726 name: hesperadin is_a: CHEBI:26151 ! piperidines is_a: CHEBI:35358 ! sulfonamide is_a: CHEBI:38459 ! oxindoles is_a: CHEBI:47989 ! enamine is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:70770 ! Aurora kinase inhibitor [Term] id: CHEBI:70727 name: topoisomerase inhibitor is_a: CHEBI:76830 ! EC 5.99.1.* (miscellaneous isomerase) inhibitor [Term] id: CHEBI:70728 name: actin polymerisation inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:70731 name: UDP-N-acetyl-alpha-D-mannosaminouronate(3-) subset: chebi_ph7_3 is_a: CHEBI:58578 ! UDP-N-acetyl-D-mannosaminouronate(3-) [Term] id: CHEBI:70738 name: UDP-N-acetyl-alpha-D-mannosaminouronic acid is_a: CHEBI:28581 ! UDP-N-acetyl-D-mannosaminouronic acid [Term] id: CHEBI:70744 name: Gly-Pro is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70749 name: O-hexanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine is_a: CHEBI:87656 ! hexanoate ester relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:70755 name: methyltelluronic acid is_a: CHEBI:33519 ! tellurium oxoacid is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:70757 name: UDP-N-acetyl-alpha-D-muramate(3-) subset: chebi_ph7_3 is_a: CHEBI:58309 ! UDP-N-acetylmuramate(3-) [Term] id: CHEBI:70758 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alaninate(3-) subset: chebi_ph7_3 is_a: CHEBI:58086 ! UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine(3-) [Term] id: CHEBI:70760 name: all-trans-retinyl oleate subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:70763 name: tritrans,heptacis-undecaprenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:70764 name: tritrans,heptacis-undecaprenyl phosphate is_a: CHEBI:27193 ! undecaprenyl phosphate [Term] id: CHEBI:70765 name: UDP-N-acetyl-alpha-D-muramic acid is_a: CHEBI:17882 ! UDP-N-acetylmuramic acid [Term] id: CHEBI:70768 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine is_a: CHEBI:17277 ! UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine [Term] id: CHEBI:70770 name: Aurora kinase inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor [Term] id: CHEBI:70771 name: 15-methylhexadecasphing-4-enine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:70773 name: capsazepine subset: chebi_ph7_3 is_a: CHEBI:33566 ! catechols is_a: CHEBI:35676 ! benzazepine is_a: CHEBI:51276 ! thioureas is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:70774 ! capsaicin receptor antagonist [Term] id: CHEBI:70774 name: capsaicin receptor antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:70775 name: N-acyl-15-methylhexadecasphing-4-enine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:70776 name: N-acyl-4-hydroxy-15-methylhexadecasphinganine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:70778 name: GW 7647 is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35683 ! aryl sulfide is_a: CHEBI:47857 ! ureas relationship: has_role CHEBI:70782 ! PPARalpha agonist [Term] id: CHEBI:70779 name: 1-deoxy-11beta-hydroxypentalenate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:70780 name: 1-deoxy-11-oxopentalenate subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion [Term] id: CHEBI:70781 name: PPAR modulator is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:70782 name: PPARalpha agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:70781 ! PPAR modulator [Term] id: CHEBI:70783 name: CDP-4-dehydro-3,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:58283 ! CDP-4-dehydro-3,6-dideoxy-D-glucose(2-) [Term] id: CHEBI:70784 name: CDP-alpha-D-abequose(2-) subset: chebi_ph7_3 is_a: CHEBI:57619 ! CDP-abequose(2-) [Term] id: CHEBI:70785 name: CDP-3,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:58110 ! CDP-3,6-dideoxy-D-glucose(2-) [Term] id: CHEBI:70786 name: C30 botryococcene subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70787 name: pentalenolactone D(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:70788 name: pentalenolactone E(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:70789 name: pentalenolactone F(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:70790 name: pentalenolactone(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:70791 name: cobalt-precorrin-7(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:70792 name: cobalt-precorrin-8(6-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:70793 name: cob(II)yrinate c monoamide(5-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:70796 name: 1-deoxy-11beta-hydroxypentalenic acid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70797 name: 1-deoxy-11-oxopentalenic acid is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:35952 ! 5-oxo monocarboxylic acid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70798 name: 15-methylhexadecasphing-4-enine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:70799 name: CDP-alpha-D-abequose is_a: CHEBI:16049 ! CDP-abequose [Term] id: CHEBI:70800 name: CDP-4-dehydro-3,6-dideoxy-alpha-D-glucose is_a: CHEBI:17817 ! CDP-4-dehydro-3,6-dideoxy-D-glucose [Term] id: CHEBI:70802 name: CDP-3,6-dideoxy-alpha-D-glucose is_a: CHEBI:17338 ! CDP-3,6-dideoxy-D-glucose [Term] id: CHEBI:70804 name: imidazol-5-ylacetic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70805 name: pentalenolactone D is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:70807 name: pentalenolactone E is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:70809 name: pentalenolactone F is_a: CHEBI:133131 ! spiro-epoxide is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:70813 name: glutamine derivative is_a: CHEBI:24315 ! glutamic acid derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:70815 name: N-acyl-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine subset: chebi_ph7_3 is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:70816 name: pentalenolactone is_a: CHEBI:133131 ! spiro-epoxide is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:70817 ! EC 1.2.1.12 [glyceraldehyde-3-phosphate dehydrogenase (phosphorylating)] inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:70817 name: EC 1.2.1.12 [glyceraldehyde-3-phosphate dehydrogenase (phosphorylating)] inhibitor is_a: CHEBI:76852 ! EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:70819 name: isovaleryl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133447 ! methyl-branched fatty acyl-L-carnitine is_a: CHEBI:73025 ! O-isovalerylcarnitine relationship: has_role CHEBI:50646 ! bone density conservation agent [Term] id: CHEBI:70820 name: cob(II)yrinic acid c monoamide is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:70826 name: isopentadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:78122 ! fatty acid anion 15:0 [Term] id: CHEBI:70827 name: isopentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:70828 name: 3-dehydro-15-methylhexadecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84411 ! 3-dehydrosphingoid base(1+) [Term] id: CHEBI:70829 name: 15-methylhexadecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:70838 name: isoheptadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:78124 ! fatty acid anion 17:0 [Term] id: CHEBI:70843 name: 3-dehydro-15-methylhexadecasphinganine is_a: CHEBI:17087 ! ketone is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:70845 name: N-acyl-15-methylhexadecasphinganine subset: chebi_ph7_3 is_a: CHEBI:139048 ! dihydroceramide [Term] id: CHEBI:70846 name: N-acyl-15-methylhexadecasphing-4-enine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:70848 name: isopentadecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:70850 name: isoheptadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:70852 name: 15-methylhexadecasphinganine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:70856 name: 2-halobenzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:70859 name: neopentalenolactone D(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:70860 name: 3-methyl-1,2-didehydro-2,3-dihydrosqualene subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70861 name: 3,22-dimethyl-1,2,23,24-tetradehydro-2,3,22,23-tetrahydrosqualene subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70862 name: 2-halobenzoic acid is_a: CHEBI:17792 ! organohalogen compound is_a: CHEBI:22723 ! benzoic acids [Term] id: CHEBI:70863 name: 3-methyl-1,2-didehydro-2,3-dihydrobotryococcene subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70864 name: 20-methyl-21,22-didehydro-20,21-dihydrobotryococcene subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70865 name: 3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene subset: chebi_ph7_3 is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70866 name: neopentalenolactone D is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:37667 ! sesquiterpene lactone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70868 name: antileishmanial agent is_a: CHEBI:35820 ! antiprotozoal drug [Term] id: CHEBI:7091 name: N-(5-phospho-beta-D-ribosyl)anthranilic acid is_a: CHEBI:21731 ! N-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:70963 name: 8-hydroxy-dADP is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate [Term] id: CHEBI:70964 name: 8-hydroxy-dAMP is_a: CHEBI:36993 ! purine 2'-deoxyribonucleoside 5'-monophosphate [Term] id: CHEBI:70968 name: 15-methylhexadecaphytosphingosine is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:27136 ! triol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:70974 name: heparan sulfate N-acetyl-alpha-D-glucosaminide polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:70975 name: heparan sulfate alpha-D-glucosaminide 3-sulfate polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer is_a: CHEBI:61660 ! organic sulfamate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:70977 name: alkane-alpha,omega-diammonium(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:70980 name: (R)-lactoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57382 ! lactoyl-CoA(4-) [Term] id: CHEBI:70982 name: reactive oxygen species generator is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:70983 name: 4-hydroxy-15-methylhexadecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:70988 name: N-monoacetylalkane-alpha,omega-diamine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:70989 name: N(4)-acetylcytidine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:22160 ! acetamides is_a: CHEBI:23524 ! cytidines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:70990 name: 3-hydroxyadipyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:70991 name: 15-methylhexadecasphing-4-enine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) [Term] id: CHEBI:70994 name: hexacyclic triterpenoid is_a: CHEBI:36615 ! triterpenoid is_a: CHEBI:51958 ! organic polycyclic compound [Term] id: CHEBI:70995 name: trans-13-methyltetradec-2-enal subset: chebi_ph7_3 is_a: CHEBI:140521 ! 13-methyltetradecenal is_a: CHEBI:51688 ! enal is_a: CHEBI:61870 ! monounsaturated fatty aldehyde [Term] id: CHEBI:70998 name: G-protein-coupled receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:71007 name: 3-dehydrohexadecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84411 ! 3-dehydrosphingoid base(1+) [Term] id: CHEBI:71008 name: 3-dehydrotetradecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84411 ! 3-dehydrosphingoid base(1+) [Term] id: CHEBI:71009 name: hexadecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:7101 name: N(5)-[(Z)-amino(hydroxyimino)methyl]ornithine is_a: CHEBI:47826 ! N(5)-[amino(hydroxyimino)methyl]ornithine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:71010 name: tetradecasphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:71011 name: hexadecasphing-4-enine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:71017 name: 1-hydroxy steroid is_a: CHEBI:35350 ! hydroxy steroid [Term] id: CHEBI:71021 name: 15-methylhexadecasphing-4-enine-1-phosphocholine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:71030 name: 15-methylhexadecasphinganine 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:76941 ! sphingoid 1-phosphate(1-) [Term] id: CHEBI:71034 name: 13-methyltetradecanal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde [Term] id: CHEBI:71036 name: 15-methylhexadecasphing-4-enine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate [Term] id: CHEBI:71038 name: 3-hydroxyadipyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA [Term] id: CHEBI:71041 name: 3-dehydrohexadecasphinganine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:71043 name: 3-dehydrotetradecasphinganine is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:71044 name: 2,3-didehydroadipoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:71045 name: bisdemethoxycurcumin subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:51689 ! enone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:78802 ! diarylheptanoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50627 ! EC 3.2.1.1 (alpha-amylase) inhibitor [Term] id: CHEBI:71046 name: tetradecasphinganine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:71048 name: (S)-dihydrocamalexate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71050 name: hexadecasphinganine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:71052 name: hexadecasphing-4-enine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:71056 name: 15-methylhexadecasphing-4-enine-1-phosphocholine is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36700 ! phosphocholines [Term] id: CHEBI:71059 name: 15-methylhexadecasphinganine 1-phosphate is_a: CHEBI:77068 ! sphingoid 1-phosphate [Term] id: CHEBI:71063 name: N-retinylidenephosphatidylethanolamine is_a: CHEBI:26537 ! retinoid is_a: CHEBI:36314 ! glycerophosphoethanolamine is_a: CHEBI:50229 ! Schiff base [Term] id: CHEBI:71156 name: N-acyl-15-methylhexadecasphing-4-enine-1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:84404 ! ceramide 1-phosphate(2-) [Term] id: CHEBI:71163 name: 2,3-didehydroadipoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA [Term] id: CHEBI:71164 name: (R)-lactoyl-CoA is_a: CHEBI:15529 ! lactoyl-CoA [Term] id: CHEBI:71165 name: N-acyl-15-methylhexadecasphing-4-enine-1-phosphate is_a: CHEBI:13956 ! ceramide 1-phosphate [Term] id: CHEBI:71175 name: 7,8-dihydromonapterin subset: chebi_ph7_3 is_a: CHEBI:25500 ! neopterins is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:71177 name: tetrahydromonapterin subset: chebi_ph7_3 is_a: CHEBI:25500 ! neopterins is_a: CHEBI:30436 ! tetrahydropterin relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:71181 name: Sir2 inhibitor is_a: CHEBI:61115 ! EC 3.5.1.98 (histone deacetylase) inhibitor [Term] id: CHEBI:71185 name: methyl 3-cyano-2-phenylpropanoate subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:25248 ! methyl ester [Term] id: CHEBI:71187 name: 3beta-hydroxy-4alpha-carboxysteroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid [Term] id: CHEBI:71188 name: 3-oxocyclopentanecarbonitrile subset: chebi_ph7_3 is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:80291 ! aliphatic nitrile [Term] id: CHEBI:71189 name: iminodiacetonitrile subset: chebi_ph7_3 is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:51308 ! dinitrile is_a: CHEBI:80291 ! aliphatic nitrile [Term] id: CHEBI:71190 name: 4-methoxy-4-oxo-3-phenylbutanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71191 name: 3-oxocyclopentanecarboxylate subset: chebi_ph7_3 is_a: CHEBI:35974 ! 4-oxo monocarboxylic acid anion [Term] id: CHEBI:71192 name: N-(cyanomethyl)glycinate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:71198 name: (2Z,4E)-2-hydroxy-6-oxohexa-2,4-dienoate subset: chebi_ph7_3 is_a: CHEBI:58068 ! 2-hydroxy-6-oxohexa-2,4-dienoate [Term] id: CHEBI:71199 name: hydroxymethylphosphonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:71203 name: beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:62130 ! beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-D-GlcpNAc relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:71207 name: (2Z,4E)-2-hydroxy-6-oxohexa-2,4-dienoic acid is_a: CHEBI:17236 ! 2-hydroxy-6-oxohexa-2,4-dienoic acid [Term] id: CHEBI:71209 name: N-(cyanomethyl)glycine is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:80291 ! aliphatic nitrile [Term] id: CHEBI:71211 name: (4-coumaroyl)acetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:71212 name: prohormone is_a: CHEBI:24432 ! biological role [Term] id: CHEBI:71213 name: 3-oxocyclopentanecarboxylic acid is_a: CHEBI:35950 ! 4-oxo monocarboxylic acid is_a: CHEBI:36132 ! alicyclic ketone [Term] id: CHEBI:71214 name: 4-methoxy-4-oxo-3-phenylbutanoic acid is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester [Term] id: CHEBI:71215 name: (4-coumaroyl)acetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:71221 name: feruloylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:71224 name: flavan-3,3',4',5,5',7-hexol subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:71227 name: (+)-epigallocatechin subset: chebi_ph7_3 is_a: CHEBI:71224 ! flavan-3,3',4',5,5',7-hexol [Term] id: CHEBI:71230 name: dihydrochalcones is_a: CHEBI:72544 ! flavonoids is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:71231 name: dihydrochalcone subset: chebi_ph7_3 is_a: CHEBI:71230 ! dihydrochalcones relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:71232 name: adenosine receptor antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:71233 name: 3-nitrotyramine is_a: CHEBI:27175 ! tyramines is_a: CHEBI:86421 ! 2-nitrophenols [Term] id: CHEBI:71234 name: N-acyl-15-methylhexadecaphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide [Term] id: CHEBI:71235 name: 4-hydroxy-3-nitrophenylacetaldehyde is_a: CHEBI:25973 ! phenylacetaldehydes is_a: CHEBI:86421 ! 2-nitrophenols [Term] id: CHEBI:71236 name: feruloylacetyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:71237 name: thiophene-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71239 name: (2Z)-4-carboxylato-2-sulfanylbut-2-enoyl-CoA(5-) is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:71241 name: thiophene-2-carboxylic acid is_a: CHEBI:48436 ! thiophenecarboxylic acid [Term] id: CHEBI:71242 name: malonyl-CoA methyl ester(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:71243 name: (2Z)-4-carboxy-2-sulfanylbut-2-enoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:71244 name: malonyl-CoA methyl ester is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:25248 ! methyl ester [Term] id: CHEBI:7125 name: 2-acetamido-2-deoxy-D-glucopyranose 1-phosphate is_a: CHEBI:21519 ! N-acetyl-D-glucosamine 1-phosphate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:71259 name: selenodiglutathione(2-) subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:71261 name: S-(2-hydroxyacyl)glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:71265 name: glutathioselenol(1-) subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:71266 name: pyrazine-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71274 name: mannooligosaccharide derivative is_a: CHEBI:63563 ! oligosaccharide derivative [Term] id: CHEBI:71277 name: 4-carboxylato-2-thioxobutanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:71285 name: organophosphonate(2-) is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:71286 name: 3-nitrotyramine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:71287 name: 4-hydroxy-3-nitrophenylacetaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:71288 name: (1->3)-alpha-D-mannooligosaccharide derivative is_a: CHEBI:71274 ! mannooligosaccharide derivative [Term] id: CHEBI:71293 name: homopolysaccharide derivative is_a: CHEBI:65212 ! polysaccharide derivative [Term] id: CHEBI:71296 name: fructan derivative is_a: CHEBI:71293 ! homopolysaccharide derivative [Term] id: CHEBI:71298 name: glucan derivative is_a: CHEBI:37164 ! homopolysaccharide [Term] id: CHEBI:71300 name: EC 2.* (transferase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:71302 name: MoO2-molybdopterin cofactor(2-) subset: chebi_ph7_3 is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71304 name: L-gamma-glutamyl-L-amino acid(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:71305 name: WO2-molybdopterin cofactor(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71306 name: MoO2-molybdopterin cofactor is_a: CHEBI:21437 ! Mo-molybdopterin cofactor [Term] id: CHEBI:71307 name: WO2-molybdopterin cofactor is_a: CHEBI:60215 ! W-molybdopterin cofactor [Term] id: CHEBI:71308 name: Mo(VI)-molybdopterin cytosine dinucleotide(2-) subset: chebi_ph7_3 is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71310 name: Mo(VI)-molybdopterin guanine dinucleotide(2-) subset: chebi_ph7_3 is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71311 name: pyrazine-2-carboxylic acid is_a: CHEBI:48345 ! pyrazinecarboxylic acid relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:49103 ! drug metabolite [Term] id: CHEBI:71312 name: bis(molybdopterin guanine dinucleotide)molybdenum(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71313 name: 4-carboxy-2-thioxobutanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:71315 name: N'-monoacetylchitobiose-6'-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71316 name: (2R,4S)-2-methyl-2,4-dihydroxydihydrofuran-3-one subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:47016 ! tetrahydrofuranone [Term] id: CHEBI:71317 name: N'-monoacetylchitobiose-6'-phosphate is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:23843 ! disaccharide phosphate [Term] id: CHEBI:71320 name: cyclopeptine subset: chebi_ph7_3 is_a: CHEBI:35500 ! 1,4-benzodiazepinone [Term] id: CHEBI:71321 name: fusidate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:71332 name: (3-nitro-4-oxidophenyl)acetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:71335 name: (3R)-7,2'-dihydroxy-4'-methoxyisoflavanol subset: chebi_ph7_3 is_a: CHEBI:142880 ! 7,2'-dihydroxy-4'-methoxyisoflavanol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:76250 ! hydroxyisoflavans is_a: CHEBI:77002 ! methoxyisoflavan [Term] id: CHEBI:71337 name: minocycline(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71338 name: autoinducer is_a: CHEBI:62488 ! signalling molecule [Term] id: CHEBI:71339 name: novobiocin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71343 name: Mo(VI)-molybdopterin guanine dinucleotide is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:37146 ! molybdopterin dinucleotide [Term] id: CHEBI:71345 name: norsolorinate anthrone(2-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71346 name: norsolorinate(2-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71352 name: L-glucoside is_a: CHEBI:24278 ! glucoside [Term] id: CHEBI:71353 name: Mo(VI)-molybdopterin cytosine dinucleotide is_a: CHEBI:21437 ! Mo-molybdopterin cofactor is_a: CHEBI:37146 ! molybdopterin dinucleotide [Term] id: CHEBI:71354 name: norsolorinic acid anthrone is_a: CHEBI:26188 ! polyketide is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46955 ! anthracenes relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:71355 name: beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:71356 name: norsolorinic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:37496 ! tetrahydroxyanthraquinone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:71358 name: UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-N(6)-(L-alanyl)-L-lysyl-D-alanyl-D-alaninate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:71361 name: 8-oxo-dAMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71362 name: 8-oxo-dADP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71363 name: 2-oxo-dADP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71365 name: rifampicin zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:71392 name: tetracycline(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71393 name: adenosine thiamine triphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71394 name: adenosine thiamine triphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:71395 name: 2-oxo-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71396 name: 2-oxo-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:71397 name: 8-oxo-dADP is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate [Term] id: CHEBI:71399 name: (beta-L-Ara4N)2-(KDO)2-lipid A(2-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:71402 name: 3-phosphonatopyruvate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71403 name: 8-oxo-dAMP is_a: CHEBI:37036 ! purine 2'-deoxyribonucleoside 5'-diphosphate [Term] id: CHEBI:71406 name: (R)-adrenaline(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:71407 name: 3-oxooctadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71408 name: 3-hydroxyoctadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71409 name: (beta-L-Ara4N)2-(KDO)2-lipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:71410 name: 7-methyl-3-oxooct-6-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:71412 name: trans-2-octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:71427 name: isotridecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:71429 name: deaminoneuraminic acid is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:71430 name: 3-oxoisopentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:183086 ! (omega-1)-methyl-3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71435 name: 3-hydroxyisopentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71437 name: isotridecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:71439 name: 3-oxoisopentadecanoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:71443 name: 3-hydroxyisopentadecanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:71445 name: 3-oxoisoheptadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:183086 ! (omega-1)-methyl-3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71446 name: 3-hydroxyisoheptadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:71449 name: hexadec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:78095 ! hexadecenoate [Term] id: CHEBI:71451 name: 3-oxodocosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71453 name: 3-oxoisoheptadecanoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:71455 name: 3-hydroxyicosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71456 name: 3-hydroxydocosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:71460 name: (E)-isopentadec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:71461 name: isoheptadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:71462 name: (E)-isoheptadec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:71464 name: palmitoyl ethanolamide subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:71465 name: palmitoleoyl ethanolamide subset: chebi_ph7_3 is_a: CHEBI:134156 ! N-acylethanolamine 16:1 is_a: CHEBI:67197 ! endocannabinoid relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:71466 name: oleoyl ethanolamide subset: chebi_ph7_3 is_a: CHEBI:134158 ! N-acylethanolamine 18:1 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:67197 ! endocannabinoid relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:70782 ! PPARalpha agonist relationship: has_role CHEBI:71551 ! EC 3.5.1.23 (ceramidase) inhibitor [Term] id: CHEBI:71467 name: (5Z,8Z,11Z,14Z,17Z)-icosapentaenoylethanolamine subset: chebi_ph7_3 is_a: CHEBI:134162 ! N-acylethanolamine 20:5 is_a: CHEBI:67197 ! endocannabinoid relationship: has_role CHEBI:71554 ! PPARgamma agonist [Term] id: CHEBI:71476 name: EC 2.3.1.85 (fatty acid synthase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:71477 name: guanosine 3'-diphosphate 5'-triphosphate(7-) is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:71481 name: (8Z,11Z,14Z)-3-oxoicosa-8,11,14-trienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:71487 name: chanoclavine-I aldehyde(1+) subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:71488 name: all-cis-8,11,14,17-icosatetraenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:36033 ! icosatetraenoic acid relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:71489 name: (6Z,9Z,12Z,15Z)-octadecatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:71490 name: precorrin-7(6-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:71491 name: (8Z,11Z,14Z,17Z)-3-oxoicosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:71492 name: (2R)-3-(3,4-dihydroxyphenyl)lactate subset: chebi_ph7_3 is_a: CHEBI:58279 ! 3-(3,4-dihydroxyphenyl)lactate is_a: CHEBI:58314 ! (2R)-2-hydroxy monocarboxylic acid anion [Term] id: CHEBI:71493 name: (R)-rosmarinate subset: chebi_ph7_3 is_a: CHEBI:58062 ! rosmarinate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:71494 name: cis-trans-nepetalactol subset: chebi_ph7_3 is_a: CHEBI:38131 ! lactol is_a: CHEBI:38606 ! cyclopentapyran [Term] id: CHEBI:71498 name: 1-O-(4-coumaroyl)-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:71499 name: cyanidin 3-O-\{6-O-[6-O-(4-coumaroyl)-beta-D-glucosyl]-2-O-beta-D-xylosyl-beta-D-galactoside} is_a: CHEBI:27351 ! xylosylgalactoside is_a: CHEBI:63571 ! trisaccharide derivative [Term] id: CHEBI:71500 name: cyclic di-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71501 name: c-GMP-AMP(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71502 name: beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:21619 ! N-acetylneuraminates is_a: CHEBI:79218 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(1-) is_a: CHEBI:88076 ! monosialotriglycosylceramide(1-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:71505 name: anthocyanidin 3-O-[6-O-(4-hydroxycinnamoyl)-beta-D-glucoside] subset: chebi_ph7_3 is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:71506 name: anthocyanidin 3-O-beta-D-sambubioside is_a: CHEBI:71583 ! anthocyanidin glycoside [Term] id: CHEBI:71507 name: anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:71509 name: anthocyanidin 3-O-sophoroside is_a: CHEBI:145470 ! sophoroside is_a: CHEBI:71583 ! anthocyanidin glycoside [Term] id: CHEBI:71510 name: anthocyanidin 3,5-di-O-beta-D-glucoside is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:71511 name: cyanin betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:71512 name: 1-O-vanilloyl-beta-D-glucose subset: chebi_ph7_3 is_a: CHEBI:52782 ! O-acyl carbohydrate [Term] id: CHEBI:71513 name: cyanidin 3,7-di-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:71515 name: cyanidin 3-O-beta-D-galactoside betaine is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:71516 name: cyanidin 3-O-[beta-D-xylosyl-(1->2)-beta-D-galactoside](1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71517 name: 2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:138140 ! 2,3-bis-O-(geranylgeranyl)-sn-glycerol 1-phospholipid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:71519 name: anthocyanidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:71522 name: anthocyanidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] 5-O-beta-D-glucoside is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:71531 name: gypsogenic acid is_a: CHEBI:24669 ! hydroxy carboxylic acid is_a: CHEBI:25872 ! pentacyclic triterpenoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:71533 name: norsolorinate(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71534 name: (S)-averantin is_a: CHEBI:64522 ! averantin [Term] id: CHEBI:71535 name: (1'S,5'S)-5'-hydroxyaverantin is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37496 ! tetrahydroxyanthraquinone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71536 name: (1'S,5'R)-5'-hydroxyaverantin subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37496 ! tetrahydroxyanthraquinone relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:71537 name: (1'S,5'S)-averufin subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:59779 ! cyclic ketal relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:71539 name: (8Z,11Z,14Z)-3-oxoicosa-8,11,14-trienoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:71540 name: isoheptadecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:71541 name: (25S)-Delta(4)-dafachronate subset: chebi_ph7_3 is_a: CHEBI:78358 ! Delta(4)-dafachronate [Term] id: CHEBI:71542 name: (25S)-Delta(7)-dafachronate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:71543 name: rotenoid is_a: CHEBI:72544 ! flavonoids is_a: CHEBI:72579 ! tetrahydrochromenochromene [Term] id: CHEBI:71544 name: (E)-isopentadec-2-enoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:71550 name: lathosterone subset: chebi_ph7_3 is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:71598 ! 3-oxo Delta(7)-steroid [Term] id: CHEBI:71551 name: EC 3.5.1.23 (ceramidase) inhibitor is_a: CHEBI:76807 ! EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor [Term] id: CHEBI:71554 name: PPARgamma agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:70781 ! PPAR modulator [Term] id: CHEBI:71556 name: (25S)-Delta(7)-dafachronic acid is_a: CHEBI:78699 ! Delta(7)-dafachronic acid relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:71560 name: (25S)-Delta(4)-dafachronic acid is_a: CHEBI:78686 ! Delta(4)-dafachronic acid relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:71563 name: all-cis-8,11,14,17-icosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:71566 name: precorrin-7 is_a: CHEBI:26228 ! precorrin [Term] id: CHEBI:71567 name: (25S)-cholestenoate subset: chebi_ph7_3 is_a: CHEBI:84146 ! 3beta-hydroxycholest-5-en-26-oate [Term] id: CHEBI:71570 name: (25R)-Delta(4)-dafachronate subset: chebi_ph7_3 is_a: CHEBI:78358 ! Delta(4)-dafachronate [Term] id: CHEBI:71572 name: (2R)-3-(3,4-dihydroxyphenyl)lactic acid is_a: CHEBI:17807 ! 3-(3,4-dihydroxyphenyl)lactic acid is_a: CHEBI:17893 ! (2R)-2-hydroxy monocarboxylic acid [Term] id: CHEBI:71573 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:61385 ! UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-D-glucosamine(1-) [Term] id: CHEBI:71574 name: (8Z,11Z,14Z,17Z)-3-oxoicosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:71576 name: 30-hydroxy-11-oxo-beta-amyrin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:71577 name: glycyrrhetaldehyde subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:36130 ! cyclic terpene ketone [Term] id: CHEBI:71578 name: cyclic di-AMP is_a: CHEBI:47037 ! cyclic purine dinucleotide is_a: CHEBI:61296 ! adenyl ribonucleotide relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:71579 name: methyl red(1-) subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:71580 name: c-GMP-AMP is_a: CHEBI:47037 ! cyclic purine dinucleotide is_a: CHEBI:61295 ! guanyl ribonucleotide is_a: CHEBI:61296 ! adenyl ribonucleotide [Term] id: CHEBI:71583 name: anthocyanidin glycoside is_a: CHEBI:16366 ! anthocyanidin cation is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:71584 name: cyanidin 3,7-di-O-beta-D-glucoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:35218 ! anthocyanin cation [Term] id: CHEBI:71586 name: (3E,5Z)-tetradecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85110 ! (3E,5Z)-dienoyl-CoA(4-) [Term] id: CHEBI:71587 name: cyanidin 3-O-[beta-D-xylosyl-(1->2)-beta-D-galactoside] is_a: CHEBI:35218 ! anthocyanin cation is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:71583 ! anthocyanidin glycoside [Term] id: CHEBI:71589 name: all-cis-icosa-8,11,14-trienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78072 ! icosatrienoate [Term] id: CHEBI:71590 name: (3E,5Z)-tetradecadienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:71591 name: 2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phospho-L-serine is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:71592 name: anthocyanidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] is_a: CHEBI:71583 ! anthocyanidin glycoside [Term] id: CHEBI:71596 name: mycocyclosin subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:65061 ! 2,5-diketopiperazines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71598 name: 3-oxo Delta(7)-steroid is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:71599 name: pulcherriminic acid is_a: CHEBI:71632 ! pyrazine N-oxide is_a: CHEBI:71633 ! hydroxypyrazine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71606 name: salvianin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:71608 name: cyclo(L-phenylalanyl-L-leucyl) subset: chebi_ph7_3 is_a: CHEBI:65061 ! 2,5-diketopiperazines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71609 name: albonoursin subset: chebi_ph7_3 is_a: CHEBI:65061 ! 2,5-diketopiperazines relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71613 name: (25R)-Delta(4)-dafachronic acid is_a: CHEBI:78686 ! Delta(4)-dafachronic acid [Term] id: CHEBI:71616 name: (25S)-cholestenoic acid is_a: CHEBI:81014 ! 3beta-hydroxycholest-5-en-26-oic acid [Term] id: CHEBI:71618 name: cyclo(dehydrophenylalanyl-L-leucyl) subset: chebi_ph7_3 is_a: CHEBI:65061 ! 2,5-diketopiperazines [Term] id: CHEBI:71619 name: UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosamine is_a: CHEBI:61440 ! UDP-3-O-[(3R)-3-hydroxytetradecanoyl]-D-glucosamine [Term] id: CHEBI:71624 name: methanetelluronate(1-) subset: chebi_ph7_3 is_a: CHEBI:33520 ! tellurium oxoanion [Term] id: CHEBI:71632 name: pyrazine N-oxide is_a: CHEBI:35580 ! N-oxide is_a: CHEBI:38314 ! pyrazines [Term] id: CHEBI:71633 name: hydroxypyrazine is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:38314 ! pyrazines [Term] id: CHEBI:71634 name: hydroxyversicolorone is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38131 ! lactol is_a: CHEBI:71652 ! anthrafuran relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71635 name: versicolorone(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71636 name: versiconol acetate(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71637 name: versiconal hemiacetal acetate is_a: CHEBI:25838 ! palmitoyl amino acid is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38131 ! lactol is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:71652 ! anthrafuran relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71638 name: versiconal hemiacetal is_a: CHEBI:38131 ! lactol is_a: CHEBI:71652 ! anthrafuran is_a: CHEBI:71662 ! versiconal [Term] id: CHEBI:71639 name: versiconol is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37496 ! tetrahydroxyanthraquinone relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:71648 name: hydroxybenzoquinone is_a: CHEBI:132130 ! hydroxyquinone is_a: CHEBI:22729 ! benzoquinones is_a: CHEBI:33823 ! enol [Term] id: CHEBI:71649 name: (S)-5'-oxoaverantin is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37496 ! tetrahydroxyanthraquinone is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71652 name: anthrafuran is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:71653 name: versicolorone tricyclic form is_a: CHEBI:37496 ! tetrahydroxyanthraquinone is_a: CHEBI:71654 ! versicolorone [Term] id: CHEBI:71654 name: versicolorone is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:71657 name: versiconol acetate is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37496 ! tetrahydroxyanthraquinone is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:71661 name: anthocyanidin 3-glucoside 5-[(6-O-4-hydroxycinnamoyl)glucoside] is_a: CHEBI:22569 ! anthocyanidin glucoside [Term] id: CHEBI:71662 name: versiconal is_a: CHEBI:25838 ! palmitoyl amino acid is_a: CHEBI:26195 ! polyphenol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:71665 name: (S)-versiconol is_a: CHEBI:71639 ! versiconol [Term] id: CHEBI:71666 name: gamma-amino acid anion is_a: CHEBI:37022 ! amino-acid anion [Term] id: CHEBI:71670 name: N-acetyl-L-methionine(1-) subset: chebi_ph7_3 is_a: CHEBI:132957 ! N-acetylmethioninate [Term] id: CHEBI:71671 name: aldonate(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:71673 name: N-acetyl-D-galactosamine 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71674 name: D-galactosamine 6-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:71677 name: (2S)-2-hydroxy-3,4-diketopentyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:71678 name: N(6)-(dimethylallyl)adenosine 5'-diphosphate is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:71679 name: N(6)-(dimethylallyl)adenosine 5'-triphosphate is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:71681 name: D-gamma-glutamyl-D-glutamate(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:71682 name: cyanidin(1-) subset: chebi_ph7_3 is_a: CHEBI:143576 ! anthocyanidin betaine is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:71683 name: D-gamma-glutamyl-D-glutamic acid is_a: CHEBI:46761 ! dipeptide [Term] id: CHEBI:71684 name: (2S)-2-hydroxy-3,4-diketopentyl phosphate is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:25381 ! monoalkyl phosphate is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:51869 ! alpha-diketone [Term] id: CHEBI:71685 name: L-4-hydroxy-2-oxoglutarate(2-) subset: chebi_ph7_3 is_a: CHEBI:17742 ! 4-hydroxy-2-oxoglutarate(2-) [Term] id: CHEBI:71688 name: 7-epi-zingiberene subset: chebi_ph7_3 is_a: CHEBI:33643 ! cycloalkene is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:26645 ! semiochemical relationship: has_role CHEBI:71692 ! insect repellent [Term] id: CHEBI:71689 name: L-4-hydroxy-2-oxoglutaric acid is_a: CHEBI:30923 ! 4-hydroxy-2-oxoglutaric acid [Term] id: CHEBI:71692 name: insect repellent is_a: CHEBI:24852 ! insecticide [Term] id: CHEBI:71711 name: phosphatidylethanolamine 32:0 subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71712 name: phosphatidylethanolamine 32:1 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71713 name: phosphatidylethanolamine 32:2 subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71718 name: phosphatidylethanolamine 34:0 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71719 name: 9-ribosyl-trans-zeatin 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:38645 ! N-glycosylzeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:71720 name: phosphatidylethanolamine 34:1 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71721 name: phosphatidylethanolamine 34:2 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71727 name: phosphatidylethanolamine 36:1 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71728 name: phosphatidylethanolamine 36:2 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71729 name: phosphatidylethanolamine 36:3 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71730 name: phosphatidylethanolamine 36:4 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71737 name: phosphatidylethanolamine 38:4 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71738 name: phosphatidylethanolamine 38:5 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71739 name: phosphatidylethanolamine 38:6 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71746 name: phosphatidylethanolamine 40:6 zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:71875 name: 9-ribosyl-trans-zeatin 5'-diphosphate is_a: CHEBI:37038 ! purine ribonucleoside 5'-diphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:38645 ! N-glycosylzeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:71938 name: 9-ribosyl-trans-zeatin 5'-triphosphate is_a: CHEBI:37045 ! purine ribonucleoside 5'-triphosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate is_a: CHEBI:38645 ! N-glycosylzeatin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:71944 name: aldehydic acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:71947 name: tyrocidine is_a: CHEBI:60004 ! mixture relationship: has_part CHEBI:29701 ! tyrocidine A relationship: has_part CHEBI:71948 ! tyrocidine B relationship: has_part CHEBI:71949 ! tyrocidine C relationship: has_part CHEBI:71950 ! tyrocidine D [Term] id: CHEBI:71948 name: tyrocidine B is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:71949 name: tyrocidine C is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:71950 name: tyrocidine D is_a: CHEBI:24613 ! homodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:71959 name: 3-amino-5-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:22494 ! aminobenzoate is_a: CHEBI:25388 ! monohydroxybenzoate [Term] id: CHEBI:71963 name: 5-amino-5-deoxy-3-dehydroshikimic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:71964 name: UDP-alpha-D-kanosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:71965 name: UDP-3-keto-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:71968 name: hydroxyflavonoid is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:38443 ! 1-benzopyran is_a: CHEBI:47916 ! flavonoid [Term] id: CHEBI:71980 name: N-retinylidene-N-retinylethanolamine subset: chebi_ph7_3 is_a: CHEBI:26537 ! retinoid is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:71981 name: beta-D-glucosylsphingosine is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:4177 ! D-glucosylsphingosine [Term] id: CHEBI:71982 name: C20 sphingosine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:71983 name: C20 sphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:71984 name: C20 dihydroceramide subset: chebi_ph7_3 is_a: CHEBI:139048 ! dihydroceramide [Term] id: CHEBI:71985 name: C20 phytoceramide subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide [Term] id: CHEBI:71986 name: C20 ceramide subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:71989 name: ortho ester subset: chebi_ph7_3 is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:71993 name: flavonol(1-) is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:72000 name: (3E,5Z)-tetradecadienoic acid is_a: CHEBI:142384 ! fatty acid 14:2 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:72001 name: (3E,5Z)-tetradecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:72003 name: 3-hydroxyisoheptadecanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:72004 name: hexadec-9-enoic acid is_a: CHEBI:24548 ! hexadecenoic acid [Term] id: CHEBI:72006 name: (E)-isoheptadec-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:72010 name: hydroxyflavan is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:38672 ! flavans [Term] id: CHEBI:72019 name: N-octacosanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:144713 ! N-(ultra-long-chain-acyl)-sphingoid base is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:7203 name: N-acetylhexosamine subset: chebi_ph7_3 is_a: CHEBI:21656 ! N-acyl-hexosamine [Term] id: CHEBI:72058 name: phosphatidylserine 34:1(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72059 name: phosphatidylserine 34:2(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72065 name: phosphatidylserine 36:1(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72066 name: phosphatidylserine 36:2(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72067 name: phosphatidylserine 36:3(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72068 name: phosphatidylserine 36:4(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72075 name: phosphatidylserine 38:4(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72076 name: phosphatidylserine 38:5(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72077 name: phosphatidylserine 38:6(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72084 name: phosphatidylserine 40:6(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:72290 name: pyrithiamine subset: chebi_ph7_3 is_a: CHEBI:50334 ! pyridinium ion [Term] id: CHEBI:72293 name: monoterpene glycoside is_a: CHEBI:25409 ! monoterpenoid is_a: CHEBI:61777 ! terpene glycoside [Term] id: CHEBI:72316 name: virulence factor is_a: CHEBI:27026 ! toxin [Term] id: CHEBI:72343 name: alpha-D-kanosamine is_a: CHEBI:72725 ! 3-amino-3-deoxy-D-glucopyranose [Term] id: CHEBI:72344 name: alpha-D-kanosamine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:72346 name: roseoflavin is_a: CHEBI:38925 ! benzopteridine relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:72381 name: lysophosphatidylethanolamine zwitterion 14:0 subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:72384 name: lysophosphatidylethanolamine zwitterion 16:0 subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:72387 name: lysophosphatidylethanolamine zwitterion 18:0 subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:72388 name: lysophosphatidylethanolamine zwitterion 18:1 subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:72389 name: lysophosphatidylethanolamine zwitterion 18:2 subset: chebi_ph7_3 is_a: CHEBI:67274 ! lysophosphatidylethanolamine zwitterion [Term] id: CHEBI:72405 name: lysophosphatidylserine 16:0(1-) subset: chebi_ph7_3 is_a: CHEBI:68497 ! lysophosphatidylserine(1-) [Term] id: CHEBI:72408 name: lysophosphatidylserine 18:0(1-) subset: chebi_ph7_3 is_a: CHEBI:68497 ! lysophosphatidylserine(1-) [Term] id: CHEBI:72409 name: lysophosphatidylserine 18:1(1-) subset: chebi_ph7_3 is_a: CHEBI:68497 ! lysophosphatidylserine(1-) [Term] id: CHEBI:72423 name: phosphatidylcholine 26:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72427 name: phosphatidylcholine 37:4 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:72447 name: 2-deoxystreptamine(1+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72453 name: poly(glycerol phosphate) teichoic acid is_a: CHEBI:30049 ! teichoic acid [Term] id: CHEBI:72454 name: poly(ribitol phosphate) teichoic acid is_a: CHEBI:30049 ! teichoic acid [Term] id: CHEBI:72455 name: poly(glucopyranosyl N-acetylgalactosamine 1-phosphate) teichoic acid is_a: CHEBI:30049 ! teichoic acid [Term] id: CHEBI:72513 name: sphingomyelin 34:0 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:72514 name: sphingomyelin 34:1 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:72518 name: sphingomyelin 36:1 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:72533 name: sphingomyelin 42:1 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:72534 name: sphingomyelin 42:2 subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:72544 name: flavonoids is_a: CHEBI:25806 ! oxygen molecular entity is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:72564 name: temozolomide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:72565 ! imidazotetrazine is_a: CHEBI:72573 ! triazene derivative relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50266 ! prodrug [Term] id: CHEBI:72565 name: imidazotetrazine is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:72571 name: pro-angiogenic agent is_a: CHEBI:50926 ! angiogenesis modulating agent [Term] id: CHEBI:72572 name: isoflavans subset: chebi_ph7_3 is_a: CHEBI:50753 ! isoflavonoid [Term] id: CHEBI:72573 name: triazene derivative subset: chebi_ph7_3 is_a: CHEBI:51143 ! nitrogen molecular entity [Term] id: CHEBI:72575 name: alarm pheromone is_a: CHEBI:26013 ! pheromone [Term] id: CHEBI:72576 name: aurones subset: chebi_ph7_3 is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:72544 ! flavonoids [Term] id: CHEBI:72579 name: tetrahydrochromenochromene is_a: CHEBI:133135 ! chromenochromene [Term] id: CHEBI:72581 name: rotenones subset: chebi_ph7_3 is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:71543 ! rotenoid [Term] id: CHEBI:72582 name: Man-1-6-Ins-1-P-Cer(t18:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:139066 ! mannosylinositol-1-phosphophytoceramide(1-) is_a: CHEBI:64991 ! mannosylinositol phosphophytoceramide(1-) [Term] id: CHEBI:72584 name: pentahydroxyflavan is_a: CHEBI:72010 ! hydroxyflavan [Term] id: CHEBI:72587 name: (R)-noradrenaline(1+) subset: chebi_ph7_3 is_a: CHEBI:166902 ! noradrenaline(1+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:72588 name: semisynthetic derivative is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:72593 name: 15-ketoprostaglandin F1alpha is_a: CHEBI:36066 ! prostaglandins Falpha relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72596 name: papulacandin is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:23007 ! carbohydrate-containing antibiotic is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:38831 ! 2-benzofurans is_a: CHEBI:72600 ! spiroketal [Term] id: CHEBI:72600 name: spiroketal is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:59779 ! cyclic ketal [Term] id: CHEBI:72606 name: 11-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72608 name: (4Z,7Z,10Z,14E,16Z,19Z)-13-hydroxydocosahexaenoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:72790 ! hydroxydocosahexaenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:72627 name: 15-HEPE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:72799 ! HEPE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72637 name: (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:72790 ! hydroxydocosahexaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:72639 name: 13-HODE is_a: CHEBI:36328 ! HODE relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72643 name: 8-HETE is_a: CHEBI:36275 ! HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72646 name: (3R,4R)-7,2'-dihydroxy-4'-methoxyisoflavanol subset: chebi_ph7_3 is_a: CHEBI:140181 ! (3R,4R)-4,2'-dihydroxyisoflavans is_a: CHEBI:71335 ! (3R)-7,2'-dihydroxy-4'-methoxyisoflavanol [Term] id: CHEBI:72647 name: 14-HDoHE is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:72790 ! hydroxydocosahexaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:72648 name: (3R)-7,2'-dihydroxy-4'-methoxyisoflavanol 4-oxonium cation is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:72649 name: cyanidin 3-O-[6-O-(4-O-beta-D-glucosyl-p-coumaroyl)-2-O-(2-O-sinapoyl-beta-D-xylosyl)-beta-D-glucosyl]-5-O-(6-O-malonyl-beta-D-glucoside)(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:72650 name: cyanidin 3-O-[6-O-(4-O-beta-D-glucosyl-p-coumaroyl)-2-O-(beta-D-xylosyl)-beta-D-glucosyl]-5-O-(6-O-malonyl-beta-D-glucoside)(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:72651 name: 9-HODE is_a: CHEBI:36328 ! HODE relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:72653 name: (4Z,7Z,10Z,13Z,16Z)-19,20-epoxydocosapentaenoic acid is_a: CHEBI:72654 ! epoxydocosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:72654 name: epoxydocosapentaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72659 name: epoxyoctadecenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72662 name: DiHOME is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72663 name: 9,10-DiHOME is_a: CHEBI:72662 ! DiHOME [Term] id: CHEBI:72665 name: 12,13-DiHOME is_a: CHEBI:72662 ! DiHOME [Term] id: CHEBI:72670 name: (2S)-versicolorone(2-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:72671 name: (2S,3S)-versiconal hemiacetal acetate is_a: CHEBI:71637 ! versiconal hemiacetal acetate [Term] id: CHEBI:72672 name: (2S-3S)-versiconal hemiacetal is_a: CHEBI:71638 ! versiconal hemiacetal [Term] id: CHEBI:72673 name: (3S)-versiconol acetate(1-) subset: chebi_ph7_3 is_a: CHEBI:71636 ! versiconol acetate(1-) [Term] id: CHEBI:72674 name: versicolorin B is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:72676 name: versicolorin A is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:72677 name: dihydrosterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:72678 name: 8-O-methyldihydrosterigmatocystin subset: chebi_ph7_3 is_a: CHEBI:26759 ! sterigmatocystins is_a: CHEBI:59770 ! cyclic acetal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72681 name: (3S)-versiconol acetate is_a: CHEBI:71657 ! versiconol acetate [Term] id: CHEBI:72682 name: 1-lauroyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:72683 name: 1-myristoyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:72687 name: bacilysin is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:32955 ! epoxide is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72692 name: polyunsaturated fatty aldehyde is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:72694 name: (2R)-dihomocitric acid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:72695 name: organic molecule is_a: CHEBI:25367 ! molecule is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:72696 name: cyanidin 3-O-[6-O-(4-O-beta-D-glucosyl-p-coumaroyl)-2-O-(2-O-sinapoyl-beta-D-xylosyl)-beta-D-glucosyl]-5-O-(6-O-malonyl-beta-D-glucoside) is_a: CHEBI:35218 ! anthocyanin cation relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72697 name: (2R)-dihomocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:72698 name: (2R)-trihomocitric acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:72699 name: (2R)-trihomocitrate(3-) subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:72700 name: 2-oxopimelic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:72701 name: 2-oxopimelate(2-) subset: chebi_ph7_3 is_a: CHEBI:36147 ! oxo dicarboxylate [Term] id: CHEBI:72704 name: chromenyliums is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35573 ! organic mancude parent [Term] id: CHEBI:72705 name: cyanidin 3-O-[6-O-(4-O-beta-D-glucosyl-p-coumaroyl)-2-O-(beta-D-xylosyl)-beta-D-glucosyl]-5-O-(6-O-malonyl-beta-D-glucoside) is_a: CHEBI:35218 ! anthocyanin cation relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72707 name: (2S)-versicolorone is_a: CHEBI:71653 ! versicolorone tricyclic form [Term] id: CHEBI:72714 name: tetracosahexaenoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72718 name: N-dodecanoylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72720 name: flavonoid oligomer is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:38443 ! 1-benzopyran is_a: CHEBI:72544 ! flavonoids [Term] id: CHEBI:72725 name: 3-amino-3-deoxy-D-glucopyranose is_a: CHEBI:72728 ! D-kanosamine [Term] id: CHEBI:72726 name: hydroxypalmitic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72728 name: D-kanosamine is_a: CHEBI:24271 ! glucosamines [Term] id: CHEBI:72730 name: flavanone glycoside is_a: CHEBI:24400 ! glycoside is_a: CHEBI:28863 ! flavanones [Term] id: CHEBI:72732 name: 3-amino-3-deoxy-D-glucopyranose(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:72737 name: lysophosphatidylcholine 17:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:72739 name: hydroxyisoflavanone is_a: CHEBI:33853 ! phenols is_a: CHEBI:38741 ! isoflavanones [Term] id: CHEBI:7274 name: N-formimidoyl-L-glutamic acid is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:83982 ! L-glutamic acid derivative [Term] id: CHEBI:72740 name: methoxyisoflavanone is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38741 ! isoflavanones [Term] id: CHEBI:72741 name: 2-arachidonyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64569 ! lysophosphatidylethanolamine 20:4 relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72744 name: 1-hexadecyl-2-hexadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:72745 name: (E)-hexadec-2-enoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion [Term] id: CHEBI:72748 name: 3-amino-3-deoxy-6-O-phosphono-D-glucopyranose(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72750 name: neosartoricin subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46955 ! anthracenes is_a: CHEBI:47622 ! acetate ester relationship: has_part CHEBI:26248 ! prenyl group relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:72755 name: kanamycin C(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72756 name: kanamycin X(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72757 name: 2'-oxokanamycin(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72758 name: sphinga-4E,8E-dienine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:72760 name: tryprostatin B subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48337 ! pyrrolopyrazine [Term] id: CHEBI:72761 name: tryprostatin A subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48337 ! pyrrolopyrazine relationship: has_role CHEBI:72771 ! breast cancer resistance protein inhibitor [Term] id: CHEBI:72762 name: 6-hydroxytryprostatin B subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48337 ! pyrrolopyrazine [Term] id: CHEBI:72763 name: fumitremorgin C subset: chebi_ph7_3 is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:72771 ! breast cancer resistance protein inhibitor [Term] id: CHEBI:72764 name: 12,13-dihydroxyfumitremorgin C subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid [Term] id: CHEBI:72765 name: verruculogen subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:51914 ! organic heterohexacyclic compound relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:50268 ! GABA modulator relationship: has_role CHEBI:50509 ! potassium channel blocker relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:72766 name: fumitremorgin A subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:51914 ! organic heterohexacyclic compound relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:72767 name: demethoxyfumitremorgin C subset: chebi_ph7_3 is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:38958 ! indole alkaloid relationship: has_role CHEBI:25442 ! mycotoxin [Term] id: CHEBI:72768 name: aryl hydrocarbon receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:72769 name: 2'-oxokanamycin is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:72771 name: breast cancer resistance protein inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:72772 name: beta-leucine is_a: CHEBI:33706 ! beta-amino acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:72775 name: methyl benzoate subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36054 ! benzoate ester relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72776 name: kunzeaol subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:68588 ! germacrane sesquiterpenoid [Term] id: CHEBI:72777 name: 7,8-dihydroneopterin 2'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72778 name: 4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72780 name: cobalt-precorrin-6B(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:72781 name: 6-tuliposide A subset: chebi_ph7_3 is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:59475 ! 6-O-acyl-D-glucose relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:72782 name: methyl (indol-3-yl)acetate subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:25248 ! methyl ester relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:72783 name: 12-HHTrE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72784 name: 7,8-dihydroneopterin 2'-phosphate is_a: CHEBI:25500 ! neopterins is_a: CHEBI:36942 ! pterin phosphate is_a: CHEBI:38797 ! dihydropterin [Term] id: CHEBI:72787 name: 4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:72788 name: 7,8-dihydromethanopterin(3-) subset: chebi_ph7_3 is_a: CHEBI:38717 ! carboxylic acid trianion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72790 name: hydroxydocosahexaenoic acid is_a: CHEBI:131863 ! docosanoid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72793 name: HETrE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:36036 ! fatty acid 20:3 relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72797 name: kanamycin X is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:72799 name: HEPE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72800 name: sphinga-4E,8E-dienine is_a: CHEBI:35785 ! sphingoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72801 name: 5-HEPE is_a: CHEBI:72799 ! HEPE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72802 name: 18-HEPE is_a: CHEBI:72799 ! HEPE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:72804 name: HOTrE is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72805 name: 2-alkyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64590 ! monoalkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:72810 name: 2'-deoxynebularine subset: chebi_ph7_3 is_a: CHEBI:142361 ! purines 2'-deoxy-D-ribonucleoside is_a: CHEBI:19254 ! purine 2'-deoxyribonucleoside [Term] id: CHEBI:72812 name: oxooctadecadienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59644 ! oxo fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72813 name: exopolysaccharide is_a: CHEBI:33694 ! biomacromolecule [Term] id: CHEBI:72823 name: glycerophosphoethanolamine zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:72824 name: 1-(Z-alk-1-enyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:18244 ! 1-alkyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:72826 name: 1-tetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64840 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72827 name: 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64840 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72828 name: 1-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64840 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72829 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:75195 ! phosphatidylglycerol 32:0(1-) is_a: CHEBI:75280 ! 1-acyl-2-palmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72830 name: 2-hexadecanoyl-1-tetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72831 name: 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72832 name: 1-[(9Z)-octadec-9-enoyl]-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72833 name: 1-hexadecanoyl-sn--glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64771 ! 1-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74463 ! lysophosphatidylinositol 16:0(1-) [Term] id: CHEBI:72834 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:75194 ! phosphatidylinositol 36:4(1-) is_a: CHEBI:75243 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:72835 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74231 ! phosphatidylinositol 32:0(1-) [Term] id: CHEBI:72836 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74232 ! phosphatidylinositol 34:0(1-) [Term] id: CHEBI:72837 name: 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74237 ! phosphatidylinositol 34:1(1-) is_a: CHEBI:75116 ! 1-acyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:72838 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74238 ! phosphatidylinositol 34:2(1-) [Term] id: CHEBI:72839 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72840 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72841 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:72845 name: 1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:75199 ! phosphatidylglycerol 36:1(1-) [Term] id: CHEBI:7285 name: N-(D-glucopyranosyl)nicotinic acid is_a: CHEBI:25533 ! N-glycosylnicotinate [Term] id: CHEBI:72850 name: icosadienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:72852 name: EpETE is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72853 name: 17(18)-EpETE is_a: CHEBI:72852 ! EpETE relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72854 name: EC 1.13.11.52 (indoleamine 2,3-dioxygenase) inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:72855 name: (4Z,7Z,10Z,13Z,19Z)-16,17-epoxydocosapentaenoic acid is_a: CHEBI:72654 ! epoxydocosapentaenoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:72857 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64861 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:72858 name: 1-hexadecanoyl-2-tetradecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64863 ! 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:72859 name: 1,2-dihexadecanoyl-sn-glycerol-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64862 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:72860 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:72864 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:72865 name: (5Z,8Z,11Z)-icosatrienoic acid is_a: CHEBI:165475 ! 5,8,11-eicosatrienoic acid [Term] id: CHEBI:72868 name: dihydroxyicosatetraenoic acid is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid [Term] id: CHEBI:72892 name: cardiolipin 70:6(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:72896 name: cardiolipin 72:4(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:72899 name: cardiolipin 72:7(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:72900 name: cardiolipin 72:8(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:72944 name: 3''-deamino-3''-hydroxykanamycin B(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72945 name: 3''-deamino-3''-hydroxykanamycin C(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72946 name: 3''-deamino-3''-hydroxykanamycin X(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72947 name: kanamycin D(3+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72948 name: deoxybrevianamide E subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48337 ! pyrrolopyrazine [Term] id: CHEBI:72949 name: chanoclavine-I(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:72950 name: (7,8-dihydropterin-6-yl)methyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72951 name: N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:72952 name: 1-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64845 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:72956 name: N-dodecanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:72957 name: N-tetradecanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:72959 name: N-hexadecanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:137569 ! Cer(d34:1) is_a: CHEBI:144703 ! N-palmitoyl-sphingoid base is_a: CHEBI:52639 ! N-acylsphingosine relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:72960 name: N-dodecanoylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:72961 name: N-octadecanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:144711 ! N-stearoyl-sphingoid base is_a: CHEBI:52639 ! N-acylsphingosine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72962 name: N-icosanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:137570 ! Cer(d38:1) is_a: CHEBI:52639 ! N-acylsphingosine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72963 name: N-hexadecanoylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:72965 name: N-tetracosanoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:52639 ! N-acylsphingosine is_a: CHEBI:85777 ! Cer(d42:1) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72990 name: 3''-deamino-3''-hydroxykanamycin B is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:72991 name: dihydrourocanate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:72992 name: 3''-deamino-3''-hydroxykanamycin X is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:72998 name: 1-hexadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64563 ! lysophosphatidylcholine 16:0 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:72999 name: 1,2-dihexadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66850 ! phosphatidylcholine 32:0 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:35195 ! surfactant relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73000 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66855 ! phosphatidylcholine 34:0 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73001 name: 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58293 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine betaine is_a: CHEBI:64517 ! phosphatidylcholine 34:1 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73002 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:60000 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphocholine betaine is_a: CHEBI:64516 ! phosphatidylcholine 34:2 [Term] id: CHEBI:73003 name: 1-palmitoyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64520 ! phosphatidylcholine 36:4 is_a: CHEBI:75063 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73004 name: 1-hexadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64381 ! 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72384 ! lysophosphatidylethanolamine zwitterion 16:0 [Term] id: CHEBI:73005 name: 1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71711 ! phosphatidylethanolamine 32:0 [Term] id: CHEBI:73006 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71718 ! phosphatidylethanolamine 34:0 zwitterion [Term] id: CHEBI:73007 name: 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71720 ! phosphatidylethanolamine 34:1 zwitterion [Term] id: CHEBI:73008 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71721 ! phosphatidylethanolamine 34:2 zwitterion [Term] id: CHEBI:73009 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71730 ! phosphatidylethanolamine 36:4 zwitterion [Term] id: CHEBI:73011 name: germacranolide is_a: CHEBI:37667 ! sesquiterpene lactone [Term] id: CHEBI:73017 name: O-isobutyrylcarnitine subset: chebi_ph7_3 is_a: CHEBI:86490 ! C4-acylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73024 name: O-acetylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73025 name: O-isovalerylcarnitine subset: chebi_ph7_3 is_a: CHEBI:86492 ! C5-acylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73026 name: 2-methylbutyrylcarnitine subset: chebi_ph7_3 is_a: CHEBI:86492 ! C5-acylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73029 name: maackiain subset: chebi_ph7_3 is_a: CHEBI:26377 ! pterocarpans is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:73030 name: (+)-maackiain subset: chebi_ph7_3 is_a: CHEBI:73029 ! maackiain [Term] id: CHEBI:73036 name: 4-hydroxy-2-oxoheptanedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:73039 name: O-octanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine is_a: CHEBI:87657 ! octanoate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73054 name: O-dodecanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine is_a: CHEBI:87659 ! dodecanoate ester relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73061 name: O-tetradecanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73067 name: O-palmitoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73078 name: 3''-deamino-3''-hydroxykanamycin C is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:73079 name: kanamycin D is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:73080 name: hemiaminal is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:73081 name: O-(15-carboxypentadecanoyl)carnitine is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73083 name: (7,8-dihydropterin-6-yl)methyl diphosphate is_a: CHEBI:30436 ! tetrahydropterin is_a: CHEBI:36942 ! pterin phosphate relationship: has_part CHEBI:68836 ! diphosphate group [Term] id: CHEBI:73084 name: N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:30436 ! tetrahydropterin is_a: CHEBI:35159 ! ribose monophosphate [Term] id: CHEBI:73087 name: dihydrourocanic acid is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:73089 name: 4-hydroxy-2-oxoheptanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid [Term] id: CHEBI:73091 name: 1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64845 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:73092 name: 1-tetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64845 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:73110 name: ganglioside GM1(1-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion is_a: CHEBI:88056 ! ganglioside GM1/1b(1-) [Term] id: CHEBI:73117 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phosphoethanolamine subset: chebi_ph7_3 is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73121 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73124 name: 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73125 name: 2,3-bis-O-phytanyl-sn-glycerol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:138139 ! 2,3-bis-O-phytanyl-sn-glycerol 1-phospholipid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:73126 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:73127 name: 1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73131 name: 2,3-bis-O-phytanyl-sn-glycerol 1-phosphate is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:73134 name: 1-hexadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:29017 ! 1-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:90452 ! lysophosphatidylethanolamine 16:0 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73136 name: EC 1.1.1.184 [carbonyl reductase (NADPH)] inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:73142 name: (S)-4-hydroxy-2-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:53800 ! 4-hydroxy-2-oxohexanoate [Term] id: CHEBI:73143 name: (S)-4-hydroxy-2-oxopentanoate subset: chebi_ph7_3 is_a: CHEBI:58222 ! 4-hydroxy-2-oxopentanoate [Term] id: CHEBI:73145 name: N-hexadecanoylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate [Term] id: CHEBI:73148 name: (S)-4-hydroxy-2-oxopentanoic acid is_a: CHEBI:17655 ! 4-hydroxy-2-oxopentanoic acid [Term] id: CHEBI:73151 name: (S)-4-hydroxy-2-oxohexanoic acid is_a: CHEBI:27530 ! 4-hydroxy-2-oxohexanoic acid [Term] id: CHEBI:73152 name: 2,6-dimethyldeca-2,4,6,8-tetraenedial subset: chebi_ph7_3 is_a: CHEBI:38124 ! dialdehyde is_a: CHEBI:51688 ! enal is_a: CHEBI:53183 ! apo carotenoid [Term] id: CHEBI:73155 name: trienoic fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid [Term] id: CHEBI:73180 name: beta-L-arabinofuranosyl-(1->2)-beta-L-arabinofuranose subset: chebi_ph7_3 is_a: CHEBI:145707 ! glycosylarabinose [Term] id: CHEBI:73181 name: EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor is_a: CHEBI:75381 ! EC 1.11.1.* (peroxidases) inhibitor [Term] id: CHEBI:73182 name: plant activator is_a: CHEBI:33286 ! agrochemical [Term] id: CHEBI:73183 name: 1-(5-phospho-beta-D-ribosyl)-ATP(6-) subset: chebi_ph7_3 is_a: CHEBI:58424 ! 1-(5-phospho-D-ribosyl)-ATP(6-) [Term] id: CHEBI:73184 name: 2-amino-4-hydroxypteridine subset: chebi_ph7_3 is_a: CHEBI:26374 ! pterin [Term] id: CHEBI:73186 name: 2,4-dihydroxypteridine subset: chebi_ph7_3 is_a: CHEBI:23792 ! dihydroxypteridine [Term] id: CHEBI:73191 name: abscisic acid receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:73194 name: 17alpha-(N-acetyl-alpha-D-glucosaminyl)estradiol 3-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:732 name: 5beta-dihydrocortisol subset: chebi_ph7_3 is_a: CHEBI:138141 ! 17alpha-hydroxy-C21-steroid is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:27136 ! triol is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:46640 ! diketone [Term] id: CHEBI:73200 name: 1-(5-phospho-beta-D-ribosyl)-ATP is_a: CHEBI:18263 ! 1-(5-phospho-D-ribosyl)-ATP [Term] id: CHEBI:73201 name: 17alpha-(N-acetyl-alpha-D-glucosaminyl)estradiol 3-glucuronoside is_a: CHEBI:26763 ! steroid glucosiduronic acid [Term] id: CHEBI:73202 name: ceramide phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:73203 name: N-acylsphingosine 1-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:73202 ! ceramide phosphoethanolamine zwitterion [Term] id: CHEBI:73204 name: ceramide phosphoethanolamine is_a: CHEBI:35786 ! phosphosphingolipid is_a: CHEBI:36711 ! phosphoethanolamine [Term] id: CHEBI:73205 name: 1,2-palmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73206 name: 1-[(9Z)-octadec-9-enoyl]-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:73207 name: 2-hexadecanoyl-1-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:73208 name: 2-hexadecanoyl-1-tetradecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:73209 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:90430 ! phosphatidylinositol(16:0/20:4) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73212 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:136493 ! phosphatidylinositol (16:0/18:2) is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol [Term] id: CHEBI:73215 name: 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol [Term] id: CHEBI:73216 name: EC 3.6.* (hydrolases acting on acid anhydrides) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:73218 name: 1-hexadecanoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:28914 ! 1-acyl-sn-glycero-3-phospho-D-myo-inositol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73223 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol [Term] id: CHEBI:73229 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol [Term] id: CHEBI:73234 name: 1-hexadecanoyl-2-[(9Z)-octadec-9-enoyl]-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73238 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73240 name: NF-kappaB inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:73241 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:73242 name: 1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:73244 name: methyl anthranilate subset: chebi_ph7_3 is_a: CHEBI:36054 ! benzoate ester relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:73245 name: cucurbitane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene [Term] id: CHEBI:73246 name: 1,2-dihexadecanoyl-sn-glycerol-3-phosphate is_a: CHEBI:64869 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate [Term] id: CHEBI:73250 name: gibberellin A1 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73251 name: gibberellin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:73252 name: gibberellin A4 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73253 name: gibberellin A3 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73254 name: 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:64864 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate [Term] id: CHEBI:73255 name: gibberellin A9(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:73256 name: gibberellin A9 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73257 name: gibberellin A20 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73258 name: gibberellin A34(1-) subset: chebi_ph7_3 is_a: CHEBI:59139 ! gibberellin carboxylic acid anion [Term] id: CHEBI:73259 name: 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:73260 name: gibberellin A34 methyl ester subset: chebi_ph7_3 is_a: CHEBI:25000 ! lactone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:73268 ! gibberellin ester [Term] id: CHEBI:73262 name: 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:73263 name: cyclooxygenase 3 inhibitor is_a: CHEBI:35544 ! EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor [Term] id: CHEBI:73264 name: 1-hexadecanoyl-2-tetradecanoyl-sn-glycero-3-phosphate is_a: CHEBI:64873 ! 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:73265 name: archaeosine residue is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:73267 name: oxidative phosphorylation inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:73268 name: gibberellin ester is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:73271 name: archaeosine is_a: CHEBI:50660 ! 7-deazaguanine ribonucleoside [Term] id: CHEBI:73281 name: (2S)-versicolorone(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:73296 name: cholecystokinin antagonist is_a: CHEBI:49020 ! hormone antagonist [Term] id: CHEBI:73299 name: cobalt(II)-factor III(8-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:73301 name: tirucallane subset: chebi_ph7_3 is_a: CHEBI:35191 ! triterpene [Term] id: CHEBI:73309 name: aromatic 2-oxo monocarboxylic acid anion subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:73311 name: adenosine receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:73315 name: 1-alkylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73316 name: 2'-deoxyribonucleoside 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73320 name: 1-(alk-1-enyl)-2-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52595 ! 1-alkyl-2-acyl-sn-glycerol is_a: CHEBI:77999 ! 1(3)-O-(alk-1-enyl)-2-acylglycerol [Term] id: CHEBI:73322 name: 1-(alk-1-enyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52569 ! 1-(alk-1-enyl)glycerol [Term] id: CHEBI:73325 name: 1-(alk-1-enyl)-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:77609 ! monoalk-1-enyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:73327 name: 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73332 ! 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:73332 name: 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:144315 ! 1-radyl-2-acyl-sn-glycerolipid is_a: CHEBI:77575 ! alkyl,acyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:78182 ! 1-alkyl-2-acyl-glycero-3-phosphate(2-) [Term] id: CHEBI:73333 name: scabicide is_a: CHEBI:22153 ! acaricide [Term] id: CHEBI:73335 name: ultraviolet filter is_a: CHEBI:52215 ! photochemical role [Term] id: CHEBI:73336 name: vulnerary is_a: CHEBI:23888 ! drug [Term] id: CHEBI:73343 name: trans-anol subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:73346 name: trans-coumaryl acetate subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33853 ! phenols is_a: CHEBI:47622 ! acetate ester [Term] id: CHEBI:73359 name: alpha-CH2-containing aldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde [Term] id: CHEBI:73360 name: EC 3.4.11.18 (methionyl aminopeptidase) inhibitor is_a: CHEBI:76787 ! EC 3.4.11.* (aminopeptidase) inhibitor [Term] id: CHEBI:73361 name: methionine aminopeptidase 2 inhibitor is_a: CHEBI:73360 ! EC 3.4.11.18 (methionyl aminopeptidase) inhibitor [Term] id: CHEBI:73373 name: cobalt(II)-factor III is_a: CHEBI:25216 ! metalloporphyrin is_a: CHEBI:33906 ! cobalt corrinoid [Term] id: CHEBI:73387 name: caldariellaquinone subset: chebi_ph7_3 is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:38836 ! 1-benzothiophenes relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73388 name: caldariellaquinol subset: chebi_ph7_3 is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:38836 ! 1-benzothiophenes relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73389 name: O-ureido-L-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:73398 name: indole skeleton subset: chebi_ph7_3 is_a: CHEBI:73541 ! organic heterobicyclic ring [Term] id: CHEBI:73418 name: 1-(1-hydroxyalkyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:15850 ! 1-O-alkyl-sn-glycerol is_a: CHEBI:5653 ! hemiacetal [Term] id: CHEBI:73423 name: 1-(alk-1-enyl)-sn-glycero-3-phosphate is_a: CHEBI:17106 ! 1-alkyl-sn-glycerol 3-phosphate is_a: CHEBI:76170 ! olefinic phospholipid [Term] id: CHEBI:73474 name: acetylenic compound subset: chebi_ph7_3 is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:73477 name: terminal acetylenic compound subset: chebi_ph7_3 is_a: CHEBI:73474 ! acetylenic compound [Term] id: CHEBI:73482 name: grixazone A(1-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:73483 name: grixazone B(2-) subset: chebi_ph7_3 is_a: CHEBI:59814 ! L-alpha-amino acid anion [Term] id: CHEBI:73500 name: 3-hydroxy-3-(4-hydroxyphenyl)propionyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:73504 name: (9Z)-octadecen-1-ol subset: chebi_ph7_3 is_a: CHEBI:77396 ! long-chain primary fatty alcohol is_a: CHEBI:78147 ! fatty alcohol 18:1 relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:38828 ! nonionic surfactant [Term] id: CHEBI:7351 name: N(4)-acetyl-L-2,4-diaminobutyric acid is_a: CHEBI:22160 ! acetamides [Term] id: CHEBI:73532 name: N(6)-(dimethylallyl)adenosine 5'-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:59724 ! ribonucleoside triphosphate oxoanion [Term] id: CHEBI:73533 name: N(6)-(dimethylallyl)adenosine 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57930 ! nucleoside 5'-diphosphate(3-) [Term] id: CHEBI:73534 name: (9Z,12Z)-octadecadien-1-ol subset: chebi_ph7_3 is_a: CHEBI:77396 ! long-chain primary fatty alcohol is_a: CHEBI:78150 ! fatty alcohol 18:2 [Term] id: CHEBI:73536 name: O-ureido-L-serine is_a: CHEBI:47857 ! ureas is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73541 name: organic heterobicyclic ring is_a: CHEBI:52845 ! cyclic organic group [Term] id: CHEBI:73542 name: N(1)-methylguanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:73543 name: 7-[(3S)-3-amino-3-carboxypropyl]wyosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:73544 name: wybutosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:73546 name: grixazone A is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:25970 ! phenoxazine is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73548 name: grixazone B is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:23509 ! cysteine derivative is_a: CHEBI:25970 ! phenoxazine is_a: CHEBI:83824 ! L-cysteine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73549 name: 3-hydroxy-3-(4-hydroxyphenyl)propionyl-CoA is_a: CHEBI:65260 ! 3-hydroxyacyl-CoA [Term] id: CHEBI:73550 name: 4-demethyl-7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:73552 name: 7-[(3S-amino)-3-carboxypropyl]wyosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:73553 name: 7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:73555 name: 7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:73556 name: 4-demethyl-7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:73557 name: 4-demethyl-7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:73558 name: D3 vitamins is_a: CHEBI:27300 ! vitamin D [Term] id: CHEBI:73559 name: 4-demethyl-7-(3-amino-3-carboxypropyl)wyosine 5'-monophosphate zwitterion is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:73599 name: 3-methylthioaspartate residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:73603 name: 7-(2-hydroxy-3-amino-3-carboxypropyl)wyosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:73610 name: Met-Ala is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73619 name: 3-methylthioaspartic acid residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:73620 name: 3-methylthioaspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:63470 ! sulfur-containing amino-acid anion [Term] id: CHEBI:73621 name: 3-methylthioaspartic acid is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83978 ! L-aspartic acid derivative is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:73624 name: 7-(2-hydroxy-3-amino-3-carboxypropyl)wyosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:73625 name: 7-(2-hydroxy-3-amino-3-carboxypropyl)wyosine 5'-monophosphate is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:73626 name: 7-(2-hydroxy-3-amino-3-carboxypropyl)wyosine 5'-monophosphate zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:73672 name: cyclic ADP-beta-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:73673 name: (S)-alpha-hydroxyglutarate-gamma-lactone subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:73674 name: carbamoyl adenylate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73675 name: 6''-O-carbamoylkanamycin A(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:73677 name: (S)-alpha-hydroxyglutaric acid-gamma-lactone is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:73678 name: tobramycin(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:73679 name: nebramycin 5'(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:73680 name: carbamoyl adenylate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:73682 name: L-threonylcarbamoyladenylate(2-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73683 name: 6''-O-carbamoylkanamycin A is_a: CHEBI:73684 ! carbamoylkanamycin [Term] id: CHEBI:73684 name: carbamoylkanamycin is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:24951 ! kanamycins [Term] id: CHEBI:73686 name: nebramycin 5' is_a: CHEBI:73684 ! carbamoylkanamycin [Term] id: CHEBI:73687 name: L-threonylcarbamoyladenylate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:73688 name: Ac-Asp-Glu is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73690 name: erythrose 4-phosphate/phosphoenolpyruvate family amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83813 ! proteinogenic amino acid [Term] id: CHEBI:73693 name: ketone body is_a: CHEBI:36586 ! carbonyl compound is_a: CHEBI:61697 ! fatty acid derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:63726 ! neuroprotective agent [Term] id: CHEBI:73702 name: wax is_a: CHEBI:59999 ! chemical substance is_a: CHEBI:61697 ! fatty acid derivative [Term] id: CHEBI:73706 name: bromosuccinate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:73709 name: (S)-2-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:64552 ! 2-hydroxybutyrate [Term] id: CHEBI:73712 name: bromosuccinic acid is_a: CHEBI:134367 ! 2-bromocarboxylic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:73722 name: hexadecanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73723 name: N-oleoylglycine is_a: CHEBI:134152 ! N-acylglycine 18:1 is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73730 name: PPARbeta/delta agonist is_a: CHEBI:48705 ! agonist is_a: CHEBI:70781 ! PPAR modulator [Term] id: CHEBI:73731 name: (11Z,14Z)-icosadienoic acid is_a: CHEBI:72850 ! icosadienoic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73743 name: 2-(3-amino-3-carboxypropyl)-L-histidine zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:73745 name: 2-[3-carboxylato-3-(dimethylammonio)propyl]-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:73747 name: uridine residue subset: chebi_ph7_3 is_a: CHEBI:50320 ! nucleoside residue [Term] id: CHEBI:73754 name: thiosugar is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:73757 name: Ala-Gly is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73762 name: Ala-Thr is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73763 name: 2-[3-carboxylato-3-(dimethylammonio)propyl]-L-histidine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:73764 name: 2-[3-carboxy-3-(dimethylamino)propyl]-L-histidine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:73770 name: Ala-Leu is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73771 name: Ala-His is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73772 name: K antigen is_a: CHEBI:65212 ! polysaccharide derivative relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:73774 name: enterobacterial common antigen is_a: CHEBI:65212 ! polysaccharide derivative relationship: has_part CHEBI:73776 ! N-acetyl-D-glucosaminyl group relationship: has_part CHEBI:73781 ! N-acetyl-D-mannosaminouronosyl group relationship: has_part CHEBI:73785 ! 4-acetamido-4,6-dideoxy-D-galactosyl group relationship: has_role CHEBI:59132 ! antigen [Term] id: CHEBI:73776 name: N-acetyl-D-glucosaminyl group subset: chebi_ph7_3 is_a: CHEBI:21524 ! N-acetyl-D-glucosaminyl groups [Term] id: CHEBI:73777 name: N-acetyl-D-mannosaminouronic acid is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:73779 name: Gly-Pro zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:73781 name: N-acetyl-D-mannosaminouronosyl group is_a: CHEBI:24403 ! glycosyl group [Term] id: CHEBI:73783 name: 4-acetamido-4,6-dideoxy-D-galactose subset: chebi_ph7_3 is_a: CHEBI:28963 ! amino sugar is_a: CHEBI:63347 ! dideoxyhexose derivative [Term] id: CHEBI:73784 name: Gly-Glu(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:73785 name: 4-acetamido-4,6-dideoxy-D-galactosyl group subset: chebi_ph7_3 is_a: CHEBI:24160 ! galactosaminyl group [Term] id: CHEBI:73786 name: Ala-Gly zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:73788 name: Ala-Gln is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73792 name: 1-arachidonoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73801 name: Gly-Glu is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73802 name: 1-nitrocyclohexene subset: chebi_ph7_3 is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:73803 name: Ala-Asp is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73841 name: lysophosphatidylcholine (P-16:0/0:0) subset: chebi_ph7_3 is_a: CHEBI:140773 ! lysophosphatidylcholine P-16:0 relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73850 name: 1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:73841 ! lysophosphatidylcholine (P-16:0/0:0) [Term] id: CHEBI:73851 name: 1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:140432 ! [(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64560 ! lysophosphatidylcholine 16:1 relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73852 name: (7Z,10Z,13Z,16Z)-3-oxodocosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:73856 name: (7Z,10Z,13Z,16Z)-docosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:149498 ! (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:73857 name: (9Z,12Z,15Z,18Z)-3-oxotetracosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:73858 name: 1-stearoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64561 ! lysophosphatidylcholine 18:0 relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:7386 name: 4-acetamidobutanal subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:73359 ! alpha-CH2-containing aldehyde relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73862 name: (5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:73863 name: (7Z,10Z,13Z,16Z,19Z)-3-oxodocosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:73870 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:149499 ! (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:73871 name: (9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:73873 name: 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:131986 ! 1-docosahexaenoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:73874 name: (9Z,12Z,15Z,18Z)-3-oxotetracosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:73876 name: (9Z,12Z,15Z,18Z,21Z)-3-oxotetracosapentaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:73883 name: UDP-alpha-D-apiose(2-) subset: chebi_ph7_3 is_a: CHEBI:57572 ! UDP-D-apiose(2-) [Term] id: CHEBI:73886 name: UDP-alpha-D-apiose is_a: CHEBI:15933 ! UDP-D-apiose [Term] id: CHEBI:73887 name: (7Z,10Z,13Z,16Z,19Z)-3-oxodocosapentaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:73888 name: Gly-Asn is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73898 name: Gly-Gln is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50267 ! protective agent [Term] id: CHEBI:73913 name: antifolate is_a: CHEBI:35221 ! antimetabolite [Term] id: CHEBI:73931 name: GDP-4-dehydro-3,6-dideoxy-alpha-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:73932 name: GDP-beta-L-colitose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:73933 name: dTDP-alpha-D-fucose(2-) subset: chebi_ph7_3 is_a: CHEBI:58172 ! dTDP-D-fucose(2-) [Term] id: CHEBI:73934 name: (S)-2-chloropropanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:73935 name: 2-chloroacrylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:73966 ! nitric oxide synthase activator [Term] id: CHEBI:73936 name: L-enduracididine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:73937 name: (3S)-3-hydroxy-L-enduracididine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:73938 name: (3S)-3-hydroxy-L-arginine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:73939 name: (3S,5S)-carbapenam-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:73940 name: GDP-4-dehydro-3,6-dideoxy-alpha-D-mannose is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:73943 name: (5R)-carbapenem-3-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:73946 name: GDP-beta-L-colitose is_a: CHEBI:21169 ! GDP-sugar [Term] id: CHEBI:73950 name: dTDP-alpha-D-fucose is_a: CHEBI:17510 ! dTDP-D-fucose [Term] id: CHEBI:73953 name: novobiocic acid(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:73954 name: 8-desmethylnovobiocic acid(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:73955 name: descarbamoylnovobiocin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:73956 name: (S)-2-chloropropanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:36685 ! chlorocarboxylic acid relationship: has_role CHEBI:50910 ! neurotoxin [Term] id: CHEBI:73957 name: desmethyldescarbamoylnovobiocin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:73962 name: (5S)-5-(carboxymethyl)-L-proline(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:73963 name: 2-chloroacrylic acid is_a: CHEBI:36685 ! chlorocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:73966 name: nitric oxide synthase activator is_a: CHEBI:195252 ! enzyme activator [Term] id: CHEBI:73969 name: L-enduracididine is_a: CHEBI:38261 ! imidazolidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:73971 name: (3S)-3-hydroxy-L-enduracididine is_a: CHEBI:38261 ! imidazolidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative is_a: CHEBI:84076 ! L-histidine derivative [Term] id: CHEBI:73972 name: (3S)-3-hydroxy-L-arginine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:24658 ! hydroxy-L-arginine is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:73973 name: beta-D-Gal-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73975 name: 3-oxo-octacosanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA [Term] id: CHEBI:73976 name: 3-oxo-octacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:73977 name: 3-oxotetracosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:73978 name: (3S,5S)-carbapenam-3-carboxylic acid is_a: CHEBI:64510 ! carbapenam [Term] id: CHEBI:73980 name: 3-oxohexacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:73984 name: beta-D-Gal-(1->4)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73986 name: beta-D-Glc-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73987 name: alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73988 name: beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73990 name: 2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134141 ! 2-acylglycerol 18:1 is_a: CHEBI:75937 ! monooleoylglycerol [Term] id: CHEBI:73991 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73993 name: alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:73995 name: 2-[(3S)-3-amino-3-carboxypropyl]-L-histidine zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:73743 ! 2-(3-amino-3-carboxypropyl)-L-histidine zwitterion residue [Term] id: CHEBI:73996 name: GDP-4-amino-4,6-dideoxy-alpha-D-mannose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:73997 name: GDP-N-acetyl-alpha-D-perosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:73998 name: 1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:73999 name: 1-hexadecanoyl-2-[(9Z)-hexadec-9-enoyl]-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71712 ! phosphatidylethanolamine 32:1 zwitterion [Term] id: CHEBI:74000 name: 1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66849 ! phosphatidylcholine 32:1 is_a: CHEBI:75240 ! 1-acyl-2-palmitoleoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74001 name: 1-O-octadecyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:15850 ! 1-O-alkyl-sn-glycerol is_a: CHEBI:34117 ! batilol [Term] id: CHEBI:74004 name: CDP-2,3-bis-O-(phytanyl)-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74005 name: 8-desmethylnovobiocic acid is_a: CHEBI:22702 ! benzamides is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74006 name: 1-archaetidyl-1D-myo-inositol 3-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:74008 name: 3-O-phospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74009 name: 3-O-methylphospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74010 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74011 name: (11Z)-3-oxoicosa-11-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:74012 name: (11Z,14Z)-3-oxoicosa-11,14-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:74020 name: diosgenin 3-O-beta-D-glucoside subset: chebi_ph7_3 is_a: CHEBI:37424 ! sterol 3-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74023 name: dioscin subset: chebi_ph7_3 is_a: CHEBI:38091 ! spirostanyl glycoside is_a: CHEBI:63571 ! trisaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:59997 ! EC 1.14.18.1 (tyrosinase) inhibitor relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:74026 name: 26-desglucoprotodioscin subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:59780 ! cyclic hemiketal is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74028 name: beta-D-Gal-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74030 name: 3'-N-debenzoyl-2'-deoxytaxol is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:50367 ! taxane diterpenoid is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:52557 ! tetracyclic diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74032 name: beta-D-Gal-(1->4)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74033 name: beta-D-Glc-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74034 name: alpha-linolenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139563 ! octadecatrienoyl-CoA(4-) [Term] id: CHEBI:74035 name: small nuclear RNA is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:74036 name: alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74037 name: (11Z)-3-oxoicosa-11-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:74038 name: beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74040 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74041 name: alpha-D-Gal-(1->3)-[alpha-L-Fuc-(1->2)]-beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:26186 ! polyprenyl phospho oligosaccharide [Term] id: CHEBI:74042 name: 2-[(3S)-3-amino-3-carboxypropyl]-L-histidine dizwitterion subset: chebi_ph7_3 is_a: CHEBI:58031 ! 2-(3-amino-3-carboxypropyl)-L-histidine dizwitterion [Term] id: CHEBI:74043 name: 2-[(3S)-3-amino-3-carboxypropyl]-L-histidine is_a: CHEBI:17144 ! 2-(3-amino-3-carboxypropyl)-L-histidine [Term] id: CHEBI:74045 name: GDP-4-amino-4,6-dideoxy-alpha-D-mannose is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:74047 name: GDP-N-acetyl-alpha-D-perosamine is_a: CHEBI:21167 ! GDP-hexose [Term] id: CHEBI:74050 name: CDP-2,3-bis-O-(phytanyl)-sn-glycerol is_a: CHEBI:35774 ! CDP-glycerols is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:74054 name: (11Z,14Z,17Z)-3-oxoicosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74068 name: erucoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74069 name: (11Z)-eicosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74070 name: (13Z)-3-oxodocosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74071 name: (15Z)-3-oxotetracosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74081 name: 1-archaetidyl-1D-myo-inositol 3-phosphate is_a: CHEBI:35771 ! glycerophosphoinositol phosphate is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:74083 name: (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74084 name: (6Z,9Z,12Z,15Z,18Z)-tetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:74086 name: (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74087 name: (9Z,12Z,15Z,18Z)-tetracosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74094 name: 3-O-phospho-[2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1->]n-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol is_a: CHEBI:74095 ! polyprenyl phospho polysaccharide [Term] id: CHEBI:74095 name: polyprenyl phospho polysaccharide is_a: CHEBI:26187 ! polyprenyl phospho carbohydrate is_a: CHEBI:37639 ! polysaccharide phosphate [Term] id: CHEBI:74097 name: 3-O-methylphospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol is_a: CHEBI:74095 ! polyprenyl phospho polysaccharide [Term] id: CHEBI:74098 name: alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-ditrans,octacis-undecaprenol is_a: CHEBI:74095 ! polyprenyl phospho polysaccharide [Term] id: CHEBI:74100 name: N-[(9Z)-octadecenoyl]sphinganine subset: chebi_ph7_3 is_a: CHEBI:136448 ! Cer(d18:0/18:1) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74105 name: aldono-1,5-lactone subset: chebi_ph7_3 is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:22302 ! aldonolactone [Term] id: CHEBI:74106 name: erucoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74109 name: (11Z,14Z)-3-oxoicosa-11,14-dienoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74114 name: (11Z,14Z,17Z)-3-oxoicosatrienoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74115 name: 2-hydroxypalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74116 name: 2-hydroxystearoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74117 name: 2-hydroxybehenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74118 name: 2-hydroxytetracosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74119 name: (3S)-3-methyl-2-oxo-3-phenylpropanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:74120 name: Gly-Met is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74122 name: (3S)-3-methyl-2-oxo-3-phenylpropanoic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid [Term] id: CHEBI:74126 name: (11Z)-eicosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:52831 ! Delta(11)-fatty acyl-CoA [Term] id: CHEBI:74127 name: (13Z)-3-oxodocosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74128 name: (15Z)-tetracosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:74146 ! C24:1-CoA(4-) [Term] id: CHEBI:74130 name: N-[(15Z)-tetracosenoyl]sphinganine subset: chebi_ph7_3 is_a: CHEBI:74160 ! C24:1-sphinganine is_a: CHEBI:85777 ! Cer(d42:1) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74132 name: N-[(17Z)-hexacosenoyl]sphinganine subset: chebi_ph7_3 is_a: CHEBI:74162 ! C26:1-sphinganine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74133 name: (15Z)-3-oxotetracosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74134 name: (17Z)-hexacosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:74161 ! C26:1-CoA(4-) [Term] id: CHEBI:74137 name: 2-hydroxyhexadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74138 name: 2-hydroxystearoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74140 name: 2-hydroxytetracosanoyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74141 name: montanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74142 name: (15Z)-tetracosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74143 name: dTDP-6-deoxy-alpha-D-allose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:74146 name: C24:1-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:74148 name: 2-hydroxybehenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74149 name: (17Z)-hexacosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74150 name: octacosanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA [Term] id: CHEBI:74151 name: S-palmitoyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:74153 name: dTDP-5,5-di-C-methyl-beta-L-lyxose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:741548 name: ethylmalonic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:74155 name: 3-dimethylallyl-4-hydroxybenzoate subset: chebi_ph7_3 is_a: CHEBI:25388 ! monohydroxybenzoate [Term] id: CHEBI:74156 name: 3-amino-4,7-dihydroxycoumarin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:74158 name: O-ureido-D-serine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:74159 name: D-cycloserine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:74160 name: C24:1-sphinganine subset: chebi_ph7_3 is_a: CHEBI:157597 ! N-tetracosenoyl-sphingoid base is_a: CHEBI:31488 ! N-acylsphinganine is_a: CHEBI:85777 ! Cer(d42:1) [Term] id: CHEBI:74161 name: C26:1-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:74162 name: C26:1-sphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:74164 name: nitrocyclohexane subset: chebi_ph7_3 is_a: CHEBI:33598 ! carbocyclic compound is_a: CHEBI:51129 ! nitrohydrocarbon [Term] id: CHEBI:74165 name: (E)-1,3-pentadiene subset: chebi_ph7_3 is_a: CHEBI:33646 ! alkadiene [Term] id: CHEBI:74166 name: C17 sphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:84410 ! sphingoid base(1+) [Term] id: CHEBI:74167 name: N-tetracosanoyl-C17-sphingosine subset: chebi_ph7_3 is_a: CHEBI:137572 ! Cer(d41:1) is_a: CHEBI:144712 ! N-(very-long-chain fatty acyl)-sphingoid base is_a: CHEBI:84445 ! N-acylheptadecasphingosine [Term] id: CHEBI:74168 name: D-ribono-1,4-lactone subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:37434 ! ribonolactone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74169 name: L-alaninamide(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:74185 name: N-tetracosenoyl-C17-sphingosine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:74212 name: O-ureido-D-serine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:47857 ! ureas is_a: CHEBI:84133 ! D-serine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74213 name: EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor is_a: CHEBI:76848 ! EC 1.17.4.* (oxidoreductase acting on CH or CH2 with a disulfide as acceptor) inhibitor [Term] id: CHEBI:74214 name: N-acetyl-alpha-D-galactosaminyl-1-diphospho-ditrans,polycis-undecaprenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74215 name: 2-hydroxytetracosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:74216 name: N-(2-hydroxytetracosenoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:74218 name: N-acetyl-alpha-D-galactosaminyl-1-diphospho-ditrans,polycis-undecaprenol is_a: CHEBI:26185 ! polyprenyl glycosyl phosphate [Term] id: CHEBI:74220 name: C17 sphingosine is_a: CHEBI:22501 ! aminodiol is_a: CHEBI:35785 ! sphingoid [Term] id: CHEBI:74222 name: gamma-lactam is_a: CHEBI:24995 ! lactam [Term] id: CHEBI:74223 name: pyrrolidin-2-ones subset: chebi_ph7_3 is_a: CHEBI:38275 ! pyrrolidinone is_a: CHEBI:74222 ! gamma-lactam [Term] id: CHEBI:74224 name: genistein(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:74228 name: 3-oxotriacontanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74229 name: (11Z,14Z,17Z,20Z,23Z)-hexacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74230 name: (13Z,16Z,19Z,22Z,25Z)-3-oxooctacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74231 name: phosphatidylinositol 32:0(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74232 name: phosphatidylinositol 34:0(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74233 name: (13Z,16Z,19Z,22Z,25Z)-octacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74237 name: phosphatidylinositol 34:1(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74238 name: phosphatidylinositol 34:2(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74240 name: phosphatidylinositol 38:4(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74243 name: 1-octadecanoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64771 ! 1-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74465 ! lysophosphatidylinositol 18:0(1-) [Term] id: CHEBI:74245 name: 1-octadecanoyl-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:65055 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:74246 name: (15Z,18Z,21Z,24Z,27Z)-3-oxotriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74247 name: (15Z,18Z,21Z,24Z,27Z)-triacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74249 name: (19Z,22Z,25Z,28Z,31Z)-3-oxotetratriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74252 name: rhizobactin 1021 is_a: CHEBI:24650 ! hydroxamic acid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:26672 ! siderophore [Term] id: CHEBI:74254 name: (17Z,20Z,23Z,26Z,29Z)-3-oxodotriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74257 name: FMN-L-threonine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74259 name: (17Z,20Z,23Z,26Z,29Z)-dotriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74260 name: (19Z,22Z,25Z,28Z,31Z)-tetratriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74261 name: (21Z,24Z,27Z,30Z,33Z)-3-oxohexatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74262 name: (21Z,24Z,27Z,30Z,33Z)-hexatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74263 name: (23Z,26Z,29Z,32Z,35Z)-3-oxooctatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74264 name: (8Z,11Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74265 name: (8Z,11Z,14Z,17Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74266 name: N-acylurea is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:74267 name: N(1)-methylguanosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74268 name: N(1)-methylguanosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74269 name: guanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:74271 name: 4-demethylwyosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74272 name: (R)-3-hydroxydecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:86041 ! 3-hydroxydecanoyl-CoA(4-) [Term] id: CHEBI:74273 name: 4-demethylwyosine 5'-monophosphate is_a: CHEBI:26561 ! ribonucleotide [Term] id: CHEBI:74275 name: 7-[(3S)-(3-amino-3-methoxycarbonyl)propyl]wyosine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:74276 name: (R)-3-hydroxylauroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74278 name: (R)-3-hydroxypalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74279 name: (R)-3-hydroxyoctanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:86040 ! 3-hydroxyoctanoyl-CoA(4-) [Term] id: CHEBI:74280 name: (R)-3-hydroxyhexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138609 ! short-chain (R)-3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74281 name: trans-2-hexacosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:74282 name: (11Z,14Z,17Z,20Z)-hexacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74283 name: (13Z,16Z,19Z,22Z)-3-oxooctacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74285 name: (13Z,16Z,19Z,22Z)-octacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74286 name: (15Z,18Z,21Z,24Z)-3-oxotriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74287 name: (15Z,18Z,21Z,24Z)-triacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74288 name: (17Z,20Z,23Z,26Z)-3-oxodotriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74289 name: (17Z,20Z,23Z,26Z)-dotriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74290 name: (19Z,22Z,25Z,28Z)-3-oxotetratriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74291 name: (19Z,22Z,25Z,28Z)-tetratriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74292 name: (21Z,24Z,27Z,30Z)-3-oxohexatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74293 name: (21Z,24Z,27Z,30Z)-hexatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74294 name: (23Z,26Z,29Z,32Z)-3-oxooctatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74296 name: (11E)-octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) is_a: CHEBI:84949 ! (11E)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74297 name: (9Z,11E)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) is_a: CHEBI:84949 ! (11E)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74298 name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:149500 ! (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74299 name: geranyllinalool subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26878 ! tertiary alcohol relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:59647 ! EC 2.3.1.50 (serine C-palmitoyltransferase) inhibitor [Term] id: CHEBI:74300 name: wybutosine 5'-monophosphate is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26561 ! ribonucleotide is_a: CHEBI:26979 ! organic heterotricyclic compound [Term] id: CHEBI:74301 name: wybutosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74304 name: (6Z,9Z,12Z,15Z,18Z,21Z)-3-oxotetracosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:74305 name: (8Z,11Z,14Z,17Z,20Z,23Z)-3-oxohexacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:74306 name: (8Z,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74307 name: heptadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74308 name: (9Z)-heptadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74309 name: pentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74310 name: (9Z)-pentadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74311 name: (10Z,13Z,16Z,19Z,22Z,25Z)-3-oxooctacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:74312 name: (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:74313 name: (12Z,15Z,18Z,21Z,24Z,27Z)-3-oxotriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) [Term] id: CHEBI:74315 name: (12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74316 name: (14Z,17Z,20Z,23Z,26Z,29Z)-3-oxodotriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74317 name: (14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74318 name: (16Z,19Z,22Z,25Z,28Z,31Z)-3-oxotetratriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74319 name: (16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74320 name: (18Z,21Z,24Z,27Z,30Z,33Z)-3-oxohexatriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143516 ! ultra-long-chain 3-oxoacyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74322 name: 4,8,12-trimethyltrideca 1,3,7,11-tetraene subset: chebi_ph7_3 is_a: CHEBI:35189 ! sesquiterpene relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74324 name: L-glyceric acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:33508 ! glyceric acid [Term] id: CHEBI:74328 name: (11Z,14Z,17Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:74329 name: (13Z,16Z,19Z)-3-oxodocosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:74334 name: (10Z,13Z,16Z,19Z)-3-oxodocosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74335 name: 1-acyl-2-(5Z,8Z,11Z,14Z,17Z)-eicosapentaenoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74337 name: D-asparagine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:74338 name: D-valine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:74339 name: (6Z)-hexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) [Term] id: CHEBI:74340 name: 1-heptadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:72737 ! lysophosphatidylcholine 17:0 [Term] id: CHEBI:74344 name: 1-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:91310 ! lysophosphatidylcholine(20:4/0:0) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74345 name: 1-(5-hydroxy-2-oxo-2,3-dihydroimidazol-4-yl)urea subset: chebi_ph7_3 is_a: CHEBI:47857 ! ureas is_a: CHEBI:55370 ! imidazolidinone [Term] id: CHEBI:74346 name: FMN-L-threonine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:74347 name: FMN-L-threonine is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:74351 name: aclacinomycin T is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:74353 name: aclacinomycin A(1+) is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:74354 name: 15-demethylaclacinomycin T zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:74355 name: 3-oxotriacontanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA [Term] id: CHEBI:74358 name: (11Z,14Z,17Z,20Z,23Z)-hexacosapentaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74359 name: L-alpha-aminobutyrate zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:74360 name: (13Z,16Z,19Z,22Z,25Z)-3-oxooctacosapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74361 name: 5-oxo-delta-bilirubin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:74362 name: 15-oxo-beta-bilirubin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:74363 name: Ala-Asp(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:74364 name: phosphatidylinositol 28:0(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74387 name: Ala-Gln zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74388 name: Ala-His zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74389 name: Ala-Leu zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74390 name: Ala-Thr zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74391 name: Gly-Asn zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74392 name: Gly-Gln zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74393 name: Gly-Met zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74394 name: Met-Ala zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:74395 name: (11E)-octadecenoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA [Term] id: CHEBI:74396 name: (9Z,11E)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA [Term] id: CHEBI:74397 name: heptadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74398 name: (9Z)-heptadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74399 name: (15Z,18Z,21Z,24Z,27Z)-3-oxotriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74400 name: (15Z,18Z,21Z,24Z,27Z)-triacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74401 name: (19Z,22Z,25Z,28Z,31Z)-3-oxotetratriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74402 name: (17Z,20Z,23Z,26Z,29Z)-3-oxodotriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74405 name: (R)-3-hydroxydecanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:86338 ! 3-hydroxydecanoyl-CoA [Term] id: CHEBI:74406 name: 3-vinylbacteriochlorophyllide a(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:74408 name: 3-dimethylallyl-4-hydroxyphenylpyruvate(1-) subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:74409 name: (17Z,20Z,23Z,26Z,29Z)-dotriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74411 name: adenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:74413 name: (13Z,16Z,19Z,22Z,25Z)-octacosapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74414 name: 3-ureidoisobutyrate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:74415 name: N(6)-dimethylallyladenine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74416 name: 2-thio-N(6)-dimethylallyladenine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74417 name: 2-methylthio-N(6)-dimethylallyladenine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74418 name: N(6)-L-threonylcarbamoyladenine 5'-monophosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74419 name: 2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74420 name: 2-methylthio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74422 name: 4'-demethylepipodophyllotoxin subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50307 ! furonaphthodioxole relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:74424 name: (10Z,13Z,16Z,19Z)-docosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:74426 name: (10Z,13Z,16Z)-3-oxodocosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74427 name: (12Z,15Z,18Z,21Z)-3-oxotetracosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:74428 name: (19Z,22Z,25Z,28Z,31Z)-tetratriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74429 name: 7-methylguanosine 5'-triphosphate(2-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74431 name: (21Z,24Z,27Z,30Z,33Z)-3-oxohexatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74432 name: N(2),N(2),N(7)-trimethylguanosine 5'-triphosphate(2-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74434 name: N(2),N(2),N(7)-trimethylguanosine 5'-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74436 name: (21Z,24Z,27Z,30Z,33Z)-hexatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74442 name: (23Z,26Z,29Z,32Z,35Z)-3-oxooctatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74443 name: 5,6-dihydrouridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74444 name: 7-[(3S)-(3-amino-3-methoxycarbonyl)propyl]wyosine 5'-phosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74445 name: 2'-O-methylguanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74446 name: 7-[(3S)-(3-amino-3-methoxycarbonyl)propyl]wyosine 5'-phosphate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:37010 ! ribonucleoside 5'-monophosphate [Term] id: CHEBI:74447 name: 5-methyluridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74449 name: N(6)-methyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74450 name: N-(15Z)-tetracosenoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:74457 ! N-tetracosenoylsphingosine is_a: CHEBI:85812 ! Cer(d42:2) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74451 name: (R)-3-hydroxylauroyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:74452 name: NMNH is_a: CHEBI:50383 ! nicotinamide mononucleotide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74454 name: 5-aminomethyl-2-thiouridine 5'-monophosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:74455 name: 5-methylaminomethyl-2-thiouridine 5'-monophosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:74457 name: N-tetracosenoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:157597 ! N-tetracosenoyl-sphingoid base is_a: CHEBI:52639 ! N-acylsphingosine is_a: CHEBI:85812 ! Cer(d42:2) [Term] id: CHEBI:74459 name: (R)-3-hydroxypalmitoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74463 name: lysophosphatidylinositol 16:0(1-) subset: chebi_ph7_3 is_a: CHEBI:68498 ! lysophosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74465 name: lysophosphatidylinositol 18:0(1-) subset: chebi_ph7_3 is_a: CHEBI:68498 ! lysophosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74466 name: lysophosphatidylinositol 18:1(1-) subset: chebi_ph7_3 is_a: CHEBI:68498 ! lysophosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:74474 name: (R)-3-hydroxyhexanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:74476 name: (11Z,14Z,17Z,20Z)-hexacosatetraenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74477 name: 2'-O-methyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74478 name: 2'-O-methyluridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74480 name: N(7)-methylguanosine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:74481 name: N(2)-methylguanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74483 name: 5-methylcytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74485 name: (13Z,16Z,19Z,22Z)-3-oxooctacosatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74486 name: N(3)-methylpseudouridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74489 name: (13Z,16Z,19Z,22Z)-octacosatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74491 name: N(1)-methyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74493 name: N(6),N(6)-dimethyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74495 name: 2'-O-methylcytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74496 name: (15Z,18Z,21Z,24Z)-3-oxotriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74497 name: 2-methyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74499 name: (15Z,18Z,21Z,24Z)-triacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74502 name: N(3)-methyluridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74503 name: Ins-1-P-Cer-A(1-) subset: chebi_ph7_3 is_a: CHEBI:139052 ! inositol-1-phosphodihydroceramide(1-) [Term] id: CHEBI:74504 name: (17Z,20Z,23Z,26Z)-3-oxodotriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74505 name: Ins-1-P-Cer-A is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:74506 name: N(4)-methylcytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74508 name: 5-carboxymethylaminomethyluridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74511 name: 5-carboxymethylaminomethyl-2'-O-methyluridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74512 name: (17Z,20Z,23Z,26Z)-dotriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74513 name: N(2),N(2)-dimethylguanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74515 name: (19Z,22Z,25Z,28Z)-3-oxotetratriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74518 name: anti-obesity agent is_a: CHEBI:52210 ! pharmacological role [Term] id: CHEBI:74519 name: (19Z,22Z,25Z,28Z)-tetratriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74522 name: (21Z,24Z,27Z,30Z)-3-oxohexatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74525 name: (21Z,24Z,27Z,30Z)-hexatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74529 name: antidote to paracetamol poisoning is_a: CHEBI:50247 ! antidote [Term] id: CHEBI:74530 name: antidote to curare poisoning is_a: CHEBI:50247 ! antidote [Term] id: CHEBI:74535 name: N-[(15Z)-tetracosenoyl]sphing-4-enine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17636 ! sphingomyelin d18:1 is_a: CHEBI:72534 ! sphingomyelin 42:2 is_a: CHEBI:83172 ! N-tetracosenoylsphingosine-1-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74543 name: 8-methyladenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74544 name: 1-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) is_a: CHEBI:84973 ! oleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:74546 name: 1,2-dioleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74917 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:83308 ! dioleoylphosphatidate(2-) [Term] id: CHEBI:74547 name: 1-linoleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74548 name: 1-linoleoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74549 name: 1-linolenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74550 name: 1-linolenoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74551 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64862 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:74552 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64861 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:74554 name: 1-heptadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74556 name: 1-heptadecanoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74558 name: 1-oleoyl-2-heptadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74560 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74563 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74565 name: 1-stearoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74572 name: (23Z,26Z,29Z,32Z)-3-oxooctatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74574 name: pentadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74575 name: (9Z)-pentadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74576 name: 1-acyl-2-(5Z,8Z,11Z,14Z,17Z)-eicosapentaenoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:74577 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:74578 name: 1-oleoyl-2-pentadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74579 name: 1-oleoyl-2-myristoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74581 name: gamma-linolenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74582 name: 1-(gamma-linolenoyl)-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74583 name: 1-icosanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74584 name: 1-icosanoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74585 name: (8Z,11Z,14Z,17Z,20Z,23Z)-3-oxohexacosahexaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74586 name: 1-myristoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74587 name: (8Z,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74588 name: (10Z,13Z,16Z,19Z,22Z,25Z)-3-oxooctacosahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74589 name: Ser-tRNA(Sec) polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:74590 name: (10Z,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74592 name: (12Z,15Z,18Z,21Z,24Z,27Z)-3-oxotriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74593 name: (12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74595 name: (14Z,17Z,20Z,23Z,26Z,29Z)-3-oxodotriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74596 name: Ins-1-P-Cer-C(1-) subset: chebi_ph7_3 is_a: CHEBI:139053 ! inositol-1-phosphophytoceramide(1-) is_a: CHEBI:64916 ! inositol phosphoceramide(1-) [Term] id: CHEBI:74597 name: Ins-1-P-Cer-C is_a: CHEBI:60245 ! inositol phosphoceramide [Term] id: CHEBI:74600 name: (14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74601 name: (16Z,19Z,22Z,25Z,28Z,31Z)-3-oxotetratriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74602 name: (16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74603 name: (18Z,21Z,24Z,27Z,30Z,33Z)-3-oxohexatriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74604 name: guanosine 2'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:78552 ! ribonucleoside 2'-monophosphate(2-) [Term] id: CHEBI:74606 name: (11Z,14Z,17Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74608 name: (13Z,16Z,19Z)-3-oxodocosatrienoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74609 name: (10Z,13Z,16Z,19Z)-3-oxodocosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74610 name: (6Z)-hexadecenoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA is_a: CHEBI:76195 ! sapienoyl bioconjugate is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:74617 name: 1-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:64379 ! 1-acyl-sn-glycero-3-phosphoserine(1-) is_a: CHEBI:72409 ! lysophosphatidylserine 18:1(1-) [Term] id: CHEBI:74619 name: aclacinomycin A is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:74620 name: 15-demethylaclacinomycin T is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:74621 name: 5-oxo-delta-bilirubin is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:36735 ! biladienes [Term] id: CHEBI:74622 name: 15-oxo-beta-bilirubin is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:36735 ! biladienes [Term] id: CHEBI:74628 name: 3-vinylbacteriochlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:74630 name: glycosyloxyisoflavone is_a: CHEBI:24400 ! glycoside is_a: CHEBI:38757 ! isoflavones [Term] id: CHEBI:74631 name: cysteamine S-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74950 ! organic phosphorothioate anion [Term] id: CHEBI:74636 name: N(6)-L-threonylcarbamoyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74637 name: N(6)-L-threonylcarbamoyladenine 5'-monophosphate is_a: CHEBI:47857 ! ureas is_a: CHEBI:48116 ! nucleotide-amino acid is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:74638 name: N(6)-dimethylallyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74640 name: N-acetyl-L-tryptophan is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:47994 ! L-tryptophan derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74642 name: 2-thio-N(6)-dimethylallyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74643 name: 2-thio-N(6)-dimethylallyladenine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:82711 ! aryl thiol [Term] id: CHEBI:74645 name: 2-methylthio-N(6)-dimethylallyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74646 name: 2-methylthio-N(6)-dimethylallyladenine 5'-monophosphate is_a: CHEBI:35683 ! aryl sulfide is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74648 name: 2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74649 name: 2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate is_a: CHEBI:47857 ! ureas is_a: CHEBI:48116 ! nucleotide-amino acid is_a: CHEBI:82711 ! aryl thiol is_a: CHEBI:84189 ! L-threonine derivative [Term] id: CHEBI:74650 name: 2-methylthio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74653 name: 3-thio-L-aspartic acid is_a: CHEBI:26834 ! sulfur-containing amino acid is_a: CHEBI:29256 ! thiol is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83978 ! L-aspartic acid derivative [Term] id: CHEBI:74655 name: 7-methylguanosine 5'-triphosphate group is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:74656 name: O(4)-phosphonato-D-tyrosine(2-) subset: chebi_ph7_3 is_a: CHEBI:74955 ! O(4)-phosphonatotyrosine(2-) [Term] id: CHEBI:74658 name: N(2),N(2),N(7)-trimethylguanosine 5'-triphosphate group is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:74659 name: N(2),N(2),N(7)-trimethylguanosine 5'-triphosphate(1+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:7466 name: nandrolone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50786 ! anabolic androgenic steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:74662 name: (10Z,13Z,16Z,19Z)-docosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:74663 name: (11Z,14Z,17Z,20Z,23Z)-3-oxohexacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:74665 name: (10Z,13Z,16Z)-3-oxodocosatrienoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74666 name: (12Z,15Z,18Z,21Z)-3-oxotetracosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74667 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64517 ! phosphatidylcholine 34:1 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:74668 name: N(2),N(2),N(7)-trimethylguanosine 5'-phosphate is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:74669 name: 1,2-dioleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58293 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine betaine is_a: CHEBI:84836 ! 1,2-di-octadecenoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:74670 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:60000 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphocholine betaine is_a: CHEBI:64523 ! phosphatidylcholine 36:3 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74671 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64525 ! phosphatidylcholine 38:5 is_a: CHEBI:75063 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74672 name: 5,6-dihydrouridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74673 name: 5,6-dihydrouridine 5'-monophosphate is_a: CHEBI:27232 ! uridine 5'-phosphate [Term] id: CHEBI:74674 name: 2'-O-methylguanosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74675 name: 5-methyluridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74676 name: N(6)-methyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74677 name: 5-aminomethyl-2-thiouridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74678 name: 5-aminomethyl-2-thiouridine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74679 name: 5-methylaminomethyl-2-thiouridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74680 name: 5-methylaminomethyl-2-thiouridine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74681 name: 2'-O-methyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74685 name: 2'-O-methyluridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74691 name: trans-2-icosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74692 name: trans-2-docosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:74693 name: trans-2-tetracosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:74694 name: 1-palmitoleoyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74697 name: 1-(9Z)-octadecenoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74720 name: N(7)-methylguanosine 5'-phosphate is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:37121 ! guanosine 5'-phosphate [Term] id: CHEBI:74721 name: N(2)-methylguanosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74722 name: N(2)-methylguanosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74724 name: 5-methylcytidine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74725 name: 5-methylcytidine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74730 name: N(3)-methylpseudouridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74731 name: N(3)-methylpseudouridine 5'-monophosphate is_a: CHEBI:37040 ! C-nucleoside phosphate [Term] id: CHEBI:74735 name: N(1)-methyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74736 name: N(1)-methyladenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74744 name: N(6),N(6)-dimethyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74748 name: 2'-O-methylcytidine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74752 name: thiophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:33461 ! phosphorus oxoanion is_a: CHEBI:79388 ! divalent inorganic anion [Term] id: CHEBI:74755 name: aclacinomycin T(1+) is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:74764 name: Cys-tRNA(Sec) polyanion is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:74769 name: 2-methyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74770 name: 2-methyladenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74771 name: N(3)-methyluridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74773 name: N(3)-methyluridine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74777 name: N(4)-methylcytidine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74778 name: N(4)-methylcytidine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74781 name: 5-carboxymethylaminomethyluridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74782 name: 5-carboxymethylaminomethyluridine 5'-monophosphate is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74783 name: astringent is_a: CHEBI:23888 ! drug [Term] id: CHEBI:74784 name: 5-carboxymethylaminomethyl-2'-O-methyluridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74785 name: 5-carboxymethylaminomethyl-2'-O-methyluridine 5'-monophosphate is_a: CHEBI:24373 ! glycine derivative is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74786 name: N(2),N(2)-dimethylguanosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74787 name: 8-methyladenosine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:74788 name: 8-methyladenosine 5'-monophosphate is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate [Term] id: CHEBI:74818 name: heteroaryl hydroxy compound is_a: CHEBI:33659 ! organic aromatic compound is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:74819 name: 2-methyl-L-serine is_a: CHEBI:134206 ! 2-methylserine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:74830 name: 1-linoleoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74831 name: 1-linolenoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74833 name: 1-linolenoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74836 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphate is_a: CHEBI:64869 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphate [Term] id: CHEBI:74839 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phosphate is_a: CHEBI:64864 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate [Term] id: CHEBI:74840 name: 1-heptadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74841 name: 1-heptadecanoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74845 name: 1-oleoyl-2-heptadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74847 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74849 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74850 name: 1-stearoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74851 name: 5-(2-methoxy-2-oxoethyl)uridine 5'-monophosphate residue(1-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74852 name: 1-oleoyl-2-pentadecanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74853 name: 2,3-bis-O-phytanyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:138139 ! 2,3-bis-O-phytanyl-sn-glycerol 1-phospholipid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:74864 name: ribose derivative is_a: CHEBI:63373 ! aldopentose derivative [Term] id: CHEBI:74882 name: 5-(carboxymethyl)uridine 5'-monophosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:7489 name: neamine is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:53628 ! 2,6-dideoxy-alpha-D-glucoside relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:74890 name: N(1)-methylpseudouridine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74892 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72067 ! phosphatidylserine 36:3(1-) is_a: CHEBI:75066 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphoserine(1-) [Term] id: CHEBI:74894 name: N(3)-methylcytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74896 name: 3'-end ribonucleotide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74897 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72076 ! phosphatidylserine 38:5(1-) is_a: CHEBI:75065 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphoserine(1-) [Term] id: CHEBI:74898 name: 3'-end 2'-O-methylribonucleotide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74900 name: N(4)-acetylcytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:74901 name: 1-oleoyl-2-palmitoleoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72059 ! phosphatidylserine 34:2(1-) [Term] id: CHEBI:74902 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72065 ! phosphatidylserine 36:1(1-) [Term] id: CHEBI:74903 name: isocaproic acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:74904 name: isocaproate subset: chebi_ph7_3 is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:74905 name: 1,2-dioleoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72066 ! phosphatidylserine 36:2(1-) [Term] id: CHEBI:74909 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72058 ! phosphatidylserine 34:1(1-) [Term] id: CHEBI:74917 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74920 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74922 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74924 name: aclacinomycin N(1+) is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:74925 name: EC 3.4.23.46 (memapsin 2) inhibitor is_a: CHEBI:76885 ! EC 3.4.23.* (aspartic endopeptidase) inhibitor [Term] id: CHEBI:74926 name: patulin subset: chebi_ph7_3 is_a: CHEBI:37581 ! gamma-lactone is_a: CHEBI:38131 ! lactol is_a: CHEBI:74927 ! furopyran relationship: has_role CHEBI:25435 ! mutagen relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:74927 name: furopyran is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:74928 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74922 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:74929 name: aclacinomycin Y(1+) is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:74930 name: 1-oleoyl-2-myristoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:74931 name: tetracenomycin F1(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:74933 name: 1-(gamma-linolenoyl)-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74934 name: tetracenomycin D3(1-) is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:74936 name: 1-(gamma-linolenoyl)-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:16196 ! oleic acid is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74937 name: 1-oleoyl-2-icosanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74938 name: 1-arachidonoyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:74939 name: 1-icosanoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74941 name: 1-arachidonoyl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74917 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:74942 name: 1-icosanoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:74943 name: 1-myristoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:74945 name: 1,5-bis(diphospho)-1D-myo-inositol 2,3,4,6-tetrakisphosphate(14-) is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:74946 name: 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:74948 name: guanosine 2'-monophosphate is_a: CHEBI:37649 ! purine ribonucleoside 2'-monophosphate relationship: has_role CHEBI:74949 ! EC 3.1.27.3 (ribonuclease T1) inhibitor [Term] id: CHEBI:74949 name: EC 3.1.27.3 (ribonuclease T1) inhibitor is_a: CHEBI:76791 ! EC 3.1.27.* (endoribonucleases producing other than 5'-phosphomonoesters) inhibitor [Term] id: CHEBI:74950 name: organic phosphorothioate anion is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:74951 name: cysteamine S-phosphate is_a: CHEBI:37512 ! organic thiophosphate is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:74955 name: O(4)-phosphonatotyrosine(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:74956 name: O(4)-phosphotyrosine is_a: CHEBI:21968 ! O-phosphoamino acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:74958 name: N-isovaleryl-L-homoserine lactone subset: chebi_ph7_3 is_a: CHEBI:55474 ! N-acyl-L-homoserine lactone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:74959 name: O(4)-phospho-D-tyrosine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:33856 ! aromatic amino acid is_a: CHEBI:74956 ! O(4)-phosphotyrosine is_a: CHEBI:84124 ! D-tyrosine derivative [Term] id: CHEBI:74960 name: homoeriodictyol subset: chebi_ph7_3 is_a: CHEBI:140331 ! 4'-hydroxyflavanones is_a: CHEBI:140351 ! 3'-methoxyflavanones is_a: CHEBI:38738 ! monomethoxyflavanone is_a: CHEBI:38739 ! trihydroxyflavanone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:74961 name: raffinose family oligosaccharide is_a: CHEBI:50699 ! oligosaccharide [Term] id: CHEBI:74963 name: 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64519 ! phosphatidylcholine 38:6 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74965 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64526 ! phosphatidylcholine 38:4 is_a: CHEBI:75063 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:74966 name: 1-lauroyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:74967 name: 1-lauroyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:75063 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:74968 name: 1-icosanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:67058 ! lysophosphatidylcholine 20:0 [Term] id: CHEBI:74969 name: mucilage is_a: CHEBI:60004 ! mixture relationship: has_part CHEBI:17309 ! pectin relationship: has_part CHEBI:72813 ! exopolysaccharide [Term] id: CHEBI:74970 name: 1-icosanoyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66862 ! phosphatidylcholine 40:4 is_a: CHEBI:75063 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:74971 name: 1-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145434 ! oleoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:64381 ! 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72388 ! lysophosphatidylethanolamine zwitterion 18:1 [Term] id: CHEBI:74972 name: (11Z,14Z,17Z,20Z,23Z)-3-oxohexacosapentaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:74974 name: N-(4-coumaroyl)-L-homoserine lactone subset: chebi_ph7_3 is_a: CHEBI:55474 ! N-acyl-L-homoserine lactone relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:74975 name: 1-oleoyl-2-arachidonoyl-sn-glycerol-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71738 ! phosphatidylethanolamine 38:5 zwitterion [Term] id: CHEBI:74977 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71729 ! phosphatidylethanolamine 36:3 zwitterion [Term] id: CHEBI:74978 name: ginsenoside is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:61778 ! triterpenoid saponin [Term] id: CHEBI:74986 name: 1,2-dioleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71728 ! phosphatidylethanolamine 36:2 zwitterion [Term] id: CHEBI:74994 name: Man-1-6-Ins-1-P-Cer C(1-) subset: chebi_ph7_3 is_a: CHEBI:139066 ! mannosylinositol-1-phosphophytoceramide(1-) is_a: CHEBI:64997 ! mannosylinositol phosphorylceramide(1-) [Term] id: CHEBI:74997 name: mannosyl diphosphorylinositol ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75017 name: 1-lauroyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:65294 ! phosphatidylcholine 28:0 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75018 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:65294 ! phosphatidylcholine 28:0 is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75020 name: 1-palmitoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:64379 ! 1-acyl-sn-glycero-3-phosphoserine(1-) is_a: CHEBI:72405 ! lysophosphatidylserine 16:0(1-) [Term] id: CHEBI:75023 name: Ins-1-P-6-Man-1-6-Ins-1-P-Cer C(2-) subset: chebi_ph7_3 is_a: CHEBI:74997 ! mannosyl diphosphorylinositol ceramide(2-) [Term] id: CHEBI:75026 name: 1-stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66855 ! phosphatidylcholine 34:0 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75028 name: 1-(alpha,beta-saturated alkyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60520 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75029 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72058 ! phosphatidylserine 34:1(1-) [Term] id: CHEBI:75031 name: 1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72059 ! phosphatidylserine 34:2(1-) [Term] id: CHEBI:75032 name: 1-palmitoyl-2-arachidonoyl-sn-glycero3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72068 ! phosphatidylserine 36:4(1-) [Term] id: CHEBI:75034 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58293 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine betaine is_a: CHEBI:84818 ! 1-octadecanoyl-2-octadecenoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75036 name: 1-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64381 ! 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72387 ! lysophosphatidylethanolamine zwitterion 18:0 [Term] id: CHEBI:75038 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:189703 ! 1-stearoyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:71727 ! phosphatidylethanolamine 36:1 zwitterion [Term] id: CHEBI:75050 name: chromogenic compound is_a: CHEBI:50411 ! one-colour indicator [Term] id: CHEBI:75051 name: 2-amino-5-chlorophenol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:75052 name: 3-dehydro-D-glucose-6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75057 name: 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:75061 name: trans-2-icosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:75062 name: 1-myristoyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:65303 ! phosphatidylcholine 30:0 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75063 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75064 name: trans-2-docosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:75065 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:75066 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:75067 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75068 name: trans-2-tetracosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:75069 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:7507 name: neomycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic relationship: has_part CHEBI:53634 ! neomycin C relationship: has_part CHEBI:7489 ! neamine relationship: has_part CHEBI:7508 ! framycetin [Term] id: CHEBI:75070 name: 1-palmitoleoyl-sn-glycerol 3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75074 name: 1-(9Z)-octadecenoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75075 name: 2,3-bis-O-phytanyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:75076 name: 1-oleoyl-2-lauroyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64865 ! 1-acyl-2-dodecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:75077 name: N(1)-methylpseudouridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:75078 name: N(1)-methylpseudouridine 5'-monophosphate is_a: CHEBI:37040 ! C-nucleoside phosphate [Term] id: CHEBI:75079 name: N(3)-methylcytidine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:7508 name: framycetin is_a: CHEBI:47779 ! aminoglycoside relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:75083 name: N(3)-methylcytidine 5'-monophosphate is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate [Term] id: CHEBI:75085 name: N(4)-acetylcytidine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:75091 name: aclacinomycin N is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:75093 name: aclacinomycin Y is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:51689 ! enone is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:75096 name: 1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:137156 ! phosphatidylserine(18:1/18:2) [Term] id: CHEBI:75099 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:7510 name: neopinone is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:75101 name: 1-oleoyl-2-palmitoleoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:75103 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:75104 name: 1-oleoyl-2-nonadecanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:75105 name: nonadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:75106 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:75109 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75110 name: 1-acyl-2-linoleoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75111 name: 1-acyl-sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:78211 ! 1-acylglycero-3-phospho-1'-glycerol(1-) [Term] id: CHEBI:75112 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75116 name: 1-acyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:75118 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:75112 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate [Term] id: CHEBI:75121 name: (11Z)-octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:75122 name: 1-oleoyl-2-(11Z)-octadecenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:75123 name: (6Z)-octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) [Term] id: CHEBI:75124 name: 1-oleoyl-2-(6Z)-octadecenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:145397 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:75127 name: alpha-N-acetylneuraminyl-(2->3)-D-galactosyl group is_a: CHEBI:24164 ! galactosyl group relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:75134 name: 1-oleoyl-2-icosanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75137 name: 2,2'-dilysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:76529 ! glycerophosphoglycerophosphoglycerol(2-) [Term] id: CHEBI:75139 name: 2-oleoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75140 name: 2'-oleoylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75141 name: 1-arachidonoyl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:74917 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:75147 name: 1-(alk-1-enyl)-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75148 name: 1-(alk-1-enyl)-2-oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17810 ! 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75150 name: 3-dehydro-D-glucose-6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:75155 name: 1-(alk-1-enyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75158 name: 1-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64840 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75160 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64875 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74364 ! phosphatidylinositol 28:0(1-) [Term] id: CHEBI:75161 name: 1-myristoyl-2-oleoyl-sn-glycero-3-phosphatidylglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:75196 ! phosphatidylglycerol 32:1(1-) [Term] id: CHEBI:75163 name: 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) is_a: CHEBI:75200 ! phosphatidylglycerol 36:2(1-) [Term] id: CHEBI:75168 name: 1-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:29017 ! 1-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:75169 name: 1-oleoyl-2-arachidonoyl-sn-glycerol-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:75173 name: 1-acyl-2-oleoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75189 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannosyl group subset: chebi_ph7_3 is_a: CHEBI:25171 ! mannosyl groups [Term] id: CHEBI:75190 name: EC 5.4.3.2 (lysine 2,3-aminomutase) inhibitor is_a: CHEBI:76829 ! EC 5.4.3.* (intramolecular transferase transferring amino groups) inhibitor [Term] id: CHEBI:75191 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-6-O-phosphonato-alpha-D-mannosyl group(2-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:75194 name: phosphatidylinositol 36:4(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:75195 name: phosphatidylglycerol 32:0(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75196 name: phosphatidylglycerol 32:1(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75199 name: phosphatidylglycerol 36:1(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75200 name: phosphatidylglycerol 36:2(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75201 name: 2-dodecanoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75203 name: 2'-lauroylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75204 name: (S)-3,5-dihydroxyphenylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:75205 name: 2'-linoleoylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75207 name: 2-palmitoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75208 name: 2-stearoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75209 name: 2-linoleoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75210 name: 3,5-dihydroxyphenylglyoxylate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:75216 name: 1-O-octadecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:75219 name: 1-palmitoyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:75414 ! platelet-activating factor receptor agonist [Term] id: CHEBI:75220 name: 1-stearoyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75230 name: 12(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:75231 name: 12-oxo-ETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131859 ! oxo-ETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:75232 name: (8R)-hydroxy-(11R,12R)-epoxyicosa-(5Z,9E,14Z)-trienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:75233 name: (8R)-hydroxy-(11S,12S)-epoxyicosa-(5Z,9E,14Z)-trienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:75234 name: (10R)-hydroxy-(11S,12S)-epoxyicosa-(5Z,8Z,14Z)-trienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:75235 name: (13R)-hydroxy-(14S,15S)-epoxyicosa-(5Z,8Z,11Z)-trienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:75238 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75239 name: 1-acyl-2-palmitoleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:7524 name: nerolidol subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:134397 ! tertiary allylic alcohol is_a: CHEBI:36757 ! farnesane sesquiterpenoid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:24527 ! herbicide relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:64857 ! cosmetic relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:75240 name: 1-acyl-2-palmitoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75241 name: 1-acyl-2-palmitoleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:75242 name: 1-acyl-2-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:75243 name: 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:75244 name: aklaviketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35294 ! carbopolycyclic compound is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:75245 name: 1-O-octadecyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:28894 ! 1-O-alkyl-2-O-arachidonoyl-sn-glycero-3-phosphocholine is_a: CHEBI:64480 ! phosphatidylcholine O-38:4 [Term] id: CHEBI:75255 name: 1-O-(alk-1-enyl)-2-octanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:75256 name: 1-O-(alk-1-enyl)-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75257 name: 1-O-(alk-1-enyl)-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75263 name: 1-acyl-2-octanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:75264 name: 1-acyl-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75265 name: 1-acyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:75266 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75268 is_obsolete: true replaced_by: CHEBI:34112 [Term] id: CHEBI:75279 name: 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75280 name: 1-acyl-2-palmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:75282 name: ergosterol biosynthesis inhibitor is_a: CHEBI:83317 ! sterol biosynthesis inhibitor [Term] id: CHEBI:75284 name: (R)-2-(4-chloro-2-methylphenoxy)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:75285 name: (S)-2-(4-chloro-2-methylphenoxy)propanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:75287 name: (S)-dichlorprop(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:75288 name: (R)-dichlorprop(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:75289 name: 1-O-(alk-1-enyl)-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17810 ! 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75290 name: 1-O-octadecyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75291 name: epsilon-rhodomycinone subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35294 ! carbopolycyclic compound is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones [Term] id: CHEBI:75294 name: 1-icosanoyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66858 ! phosphatidylcholine 36:0 is_a: CHEBI:75279 ! 1-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:75296 name: 13-dihydrodaunorubicin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75297 name: 13-deoxydaunorubicin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75300 name: 1-palmitoyl-2-decanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:72423 ! phosphatidylcholine 26:0 is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:75301 name: 1-palmitoyl-2-hexanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine is_a: CHEBI:87656 ! hexanoate ester [Term] id: CHEBI:75302 name: 1-palmitoyl-2-capryloyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:85564 ! phosphatidylcholine 24:0 is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:75304 name: 1-palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:65303 ! phosphatidylcholine 30:0 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:75305 name: glutamine hydroxamate is_a: CHEBI:24315 ! glutamic acid derivative is_a: CHEBI:24650 ! hydroxamic acid [Term] id: CHEBI:75306 name: 2-heptyl-4-hydroxyquinoline subset: chebi_ph7_3 is_a: CHEBI:38775 ! monohydroxyquinoline relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:75308 name: 19-oxotestosterone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen [Term] id: CHEBI:75309 name: aklanonate is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:75311 name: methyl aklanonate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37484 ! dihydroxyanthraquinone [Term] id: CHEBI:75320 name: 2-amino-5-chloro-cis,cis-muconic 6-semialdehyde is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:38436 ! muconic semialdehyde is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75322 name: 8(S)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:146288 ! 8-HPETE(1-) is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:75325 name: cathartic is_a: CHEBI:52208 ! biophysical role [Term] id: CHEBI:75326 name: 8-oxo-ETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131859 ! oxo-ETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:75327 name: (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate subset: chebi_ph7_3 is_a: CHEBI:137328 ! epoxy(hydroxy)icosatrienoate [Term] id: CHEBI:75332 name: nonadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:75341 name: (8E,10S)-10-hydroperoxy-8-octadecenoate subset: chebi_ph7_3 is_a: CHEBI:133557 ! hydroperoxyoctadecenoate is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:64012 ! hydroperoxy fatty acid anion [Term] id: CHEBI:75342 name: 1-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134130 ! 1-acylglycerol 18:1 is_a: CHEBI:75937 ! monooleoylglycerol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:75346 name: (8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoate subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) [Term] id: CHEBI:75348 name: (8E,10S,12Z,15Z)-10-hydroperoxyoctadec-8,12,15-trienoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:75354 name: (11Z)-octadecenoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA [Term] id: CHEBI:75357 name: 1-oleoyl-2-(11Z)-octadecenoyl-sn-glycero-3-phosphate is_a: CHEBI:134237 ! phosphatidic acid 36:2 is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75360 name: (6Z)-octadecenoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:75363 name: 1-oleoyl-2-(6Z)-octadecenoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:75370 name: 2-(2,4-dichlorophenoxy)propanoic acid is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:75373 name: (R)-dichlorprop is_a: CHEBI:75370 ! 2-(2,4-dichlorophenoxy)propanoic acid relationship: has_role CHEBI:26841 ! synthetic auxin relationship: has_role CHEBI:33286 ! agrochemical relationship: has_role CHEBI:60575 ! phenoxy herbicide relationship: has_role CHEBI:75380 ! EC 1.11.1.6 (catalase) inhibitor [Term] id: CHEBI:75374 name: (S)-dichlorprop is_a: CHEBI:75370 ! 2-(2,4-dichlorophenoxy)propanoic acid [Term] id: CHEBI:75376 name: 1-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64845 ! 1-acyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:75378 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:64890 ! 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75380 name: EC 1.11.1.6 (catalase) inhibitor is_a: CHEBI:75381 ! EC 1.11.1.* (peroxidases) inhibitor [Term] id: CHEBI:75381 name: EC 1.11.1.* (peroxidases) inhibitor is_a: CHEBI:76738 ! EC 1.11.* (oxidoreductase acting on peroxide as donors) inhibitor [Term] id: CHEBI:75385 name: 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:7539 name: 5-amino-3,5-dideoxy-D-glycero-D-galacto-non-2-ulopyranosonic acid is_a: CHEBI:49018 ! neuraminic acid [Term] id: CHEBI:75397 name: N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannose subset: chebi_ph7_3 is_a: CHEBI:22484 ! galactosamine oligosaccharide is_a: CHEBI:22485 ! glucosamine oligosaccharide is_a: CHEBI:59266 ! amino trisaccharide [Term] id: CHEBI:7540 name: neurosporaxanthin is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:53185 ! apo carotenoid C35 terpenoid [Term] id: CHEBI:75402 name: 2-methyl-6-all-trans-nonaprenyl-1,4-benzoquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone is_a: CHEBI:64532 ! dihydroxytoluene [Term] id: CHEBI:75406 name: 2-methyl-6-phytylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:64532 ! dihydroxytoluene [Term] id: CHEBI:75407 name: 2,3-dimethyl-6-phytylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones [Term] id: CHEBI:75411 name: 2-methyl-6-geranylgeranyl-1,4-benzoquinol subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:75412 name: 2,3-dimethyl-6-geranylgeranyl-1,4-benzoquinol subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:75414 name: platelet-activating factor receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:75416 name: EC 6.1.1.* (ligases forming aminoacyl tRNA and related compounds) inhibitor is_a: CHEBI:76706 ! EC 6.1.* (C-O bond-forming ligase) inhibitor [Term] id: CHEBI:75431 name: ghrelin is_a: CHEBI:15841 ! polypeptide is_a: CHEBI:25905 ! peptide hormone relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50779 ! appetite enhancer relationship: has_role CHEBI:50855 ! antiatherogenic agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:75434 name: phytyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58404 ! (E)-3,7,11,15-tetramethylhexadec-2-en-1-yl diphosphate(3-) [Term] id: CHEBI:75443 name: 1-butyryl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:197386 ! 1-butanoyl-2-oleoylglycerol is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:75447 name: 1-oleoyl-2-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:76065 ! 1-oleoyl-2-palmitoylglycerol [Term] id: CHEBI:75448 name: 1-oleoyl-2-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:75449 name: 1-oleoyl-2-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75450 name: 1-oleoyl-2-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75455 name: 2-palmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134138 ! 2-acylglycerol 16:0 relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:75456 name: 2-stearoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134140 ! 2-acylglycerol 18:0 [Term] id: CHEBI:75457 name: 2-linoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134142 ! 2-acylglycerol 18:2 [Term] id: CHEBI:75462 name: 1-octanoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:197391 ! 1-octanoyl-2-oleoylglycerol is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:75463 name: 1-lauroyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75579 ! 1-lauroyl-2-oleoylglycerol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75465 name: 1-myristoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75582 ! 1-myristoyl-2-oleoylglycerol is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75466 name: 1-palmitoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75585 ! 1-palmitoyl-2-oleoylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75468 name: 1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75590 ! 1-stearoyl-2-oleoylglycerol is_a: CHEBI:86980 ! diacylglycerol 36:1 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75470 name: 1-icosanoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:197392 ! 1-icosanoyl-2-oleoylglycerol [Term] id: CHEBI:75471 name: 1-linoleoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75614 ! 1-linoleoyl-2-oleoylglycerol [Term] id: CHEBI:75472 name: 1-arachidonoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:75611 ! 1-arachidonoyl-2-oleoylglycerol [Term] id: CHEBI:75480 name: Ins-1-P-Cer-A 42:0(1-) subset: chebi_ph7_3 is_a: CHEBI:74503 ! Ins-1-P-Cer-A(1-) [Term] id: CHEBI:75481 name: Ins-1-P-Cer-A 44:0(1-) subset: chebi_ph7_3 is_a: CHEBI:74503 ! Ins-1-P-Cer-A(1-) [Term] id: CHEBI:75483 name: phytyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75504 name: pyranoside subset: chebi_ph7_3 is_a: CHEBI:24400 ! glycoside [Term] id: CHEBI:75507 name: 3-dehydropyranoside subset: chebi_ph7_3 is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:63391 ! ketohexose derivative [Term] id: CHEBI:75522 name: beta-L-galactose 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58908 ! L-galactose 1-phosphate(2-) relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:75524 name: 2,3-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75525 name: D-galactopyranuronate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:75528 name: 3-lauroyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75539 ! 1-monolauroylglycerol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75529 name: 1-lauroyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75539 ! 1-monolauroylglycerol [Term] id: CHEBI:75533 name: 3-lauroyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75579 ! 1-lauroyl-2-oleoylglycerol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75536 name: 1-myristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75562 ! 1-monomyristoylglycerol [Term] id: CHEBI:75537 name: 3-myristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75562 ! 1-monomyristoylglycerol [Term] id: CHEBI:75539 name: 1-monolauroylglycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75540 name: 2-oleoyl-3-myristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75582 ! 1-myristoyl-2-oleoylglycerol is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:75542 name: 1-hexadecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:69081 ! 1-monopalmitoylglycerol is_a: CHEBI:87251 ! monoacylglycerol 16:0 [Term] id: CHEBI:75545 name: 2-keto-3-deoxy-L-galactonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:75546 name: 2-oleoyl-3-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75585 ! 1-palmitoyl-2-oleoylglycerol [Term] id: CHEBI:75547 name: 1-monodecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:90605 ! monodecanoylglycerol [Term] id: CHEBI:75550 name: 1-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75555 ! 1-monostearoylglycerol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:75553 name: 3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75555 ! 1-monostearoylglycerol [Term] id: CHEBI:75555 name: 1-monostearoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134129 ! 1-acylglycerol 18:0 relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:75558 name: 2-oleoyl-3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75590 ! 1-stearoyl-2-oleoylglycerol [Term] id: CHEBI:75561 name: 1-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75568 ! 1-monolinolein [Term] id: CHEBI:75562 name: 1-monomyristoylglycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:75563 name: 3-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75568 ! 1-monolinolein [Term] id: CHEBI:75568 name: 1-monolinolein subset: chebi_ph7_3 is_a: CHEBI:134131 ! 1-acylglycerol 18:2 relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:75569 name: 3-linoleoyl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75614 ! 1-linoleoyl-2-oleoylglycerol [Term] id: CHEBI:75571 name: 3-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75612 ! 1-arachidonoylglycerol [Term] id: CHEBI:75573 name: 2-oleoyl-3-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75611 ! 1-arachidonoyl-2-oleoylglycerol [Term] id: CHEBI:75579 name: 1-lauroyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:75582 name: 1-myristoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride is_a: CHEBI:85687 ! diacylglycerol 32:1 is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:75583 name: 1,2-dioleoyl-3-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol is_a: CHEBI:75848 ! 1,2-dioleoyl-3-palmitoylglycerol [Term] id: CHEBI:75584 name: palmityl palmitate subset: chebi_ph7_3 is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75585 name: 1-palmitoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75586 name: 1,2-hexadecanediol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol [Term] id: CHEBI:75587 name: 2-hydroxypalmityl palmitate subset: chebi_ph7_3 is_a: CHEBI:25835 ! hexadecanoate ester [Term] id: CHEBI:75590 name: 1-stearoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75591 is_obsolete: true replaced_by: CHEBI:17427 [Term] id: CHEBI:75592 name: L-cycloserine is_a: CHEBI:23503 ! 4-amino-1,2-oxazolidin-3-one relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:59647 ! EC 2.3.1.50 (serine C-palmitoyltransferase) inhibitor relationship: has_role CHEBI:64946 ! anti-HIV agent [Term] id: CHEBI:75596 name: EC 5.* (isomerase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:75600 name: EC 6.3.* (C-N bond-forming ligase) inhibitor is_a: CHEBI:75603 ! EC 6.* (ligase) inhibitor [Term] id: CHEBI:75603 name: EC 6.* (ligase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:75604 name: EC 6.4.* (C-C bond-forming ligase) inhibitor is_a: CHEBI:75603 ! EC 6.* (ligase) inhibitor [Term] id: CHEBI:75606 name: hydroxamic acid ester subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:75608 name: 2-palmitoyloxypalmityl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester [Term] id: CHEBI:75609 name: 1-alpha-linolenoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75610 name: 1-alpha-linolenoylglycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride [Term] id: CHEBI:75611 name: 1-arachidonoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75612 name: 1-arachidonoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134133 ! 1-acylglycerol 20:4 [Term] id: CHEBI:75614 name: 1-linoleoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:75615 name: (8E,10S,12Z,15Z)-10-hydroperoxyoctadeca-8,12,15-trienoic acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:75616 name: gentamicin C(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75617 name: N(3')-acetylgentamycin C(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75620 name: decyl oleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75622 name: palmityl oleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75623 name: palmitoleyl alcohol subset: chebi_ph7_3 is_a: CHEBI:24546 ! hexadecen-1-ol relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:75624 name: palmitoleyl oleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75625 name: stearyl oleate subset: chebi_ph7_3 is_a: CHEBI:132449 ! wax ester 36:1 [Term] id: CHEBI:75626 name: oleyl oleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75627 name: icosan-1-ol subset: chebi_ph7_3 is_a: CHEBI:197480 ! icosanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:75628 name: arachidyl oleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75629 name: palmityl palmitoleate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:75631 name: palmityl stearate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:75925 ! octadecanoate ester [Term] id: CHEBI:75634 name: L-erythro-3-methylmalyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:75635 name: mesaconyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:75636 name: 3-methylfumaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:75637 name: (3R)-citramalyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:57320 ! citramalyl-CoA(5-) [Term] id: CHEBI:75645 name: 1-acyl-2-palmitoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:75646 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) [Term] id: CHEBI:75649 name: 5-(2-methoxy-2-oxoethyl)uridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:75650 name: 5-(2-methoxy-2-oxoethyl)uridine 5'-monophosphate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27232 ! uridine 5'-phosphate [Term] id: CHEBI:75657 name: 5-(carboxymethyl)uridine 5'-monophosphate is_a: CHEBI:27237 ! uridine phosphate [Term] id: CHEBI:75658 name: 5-(carboxymethyl)uridine 5'-monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:75659 name: O-acyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:75665 name: (2S,3R)-capreomycidine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:75688 name: 1,3-dipalmitoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:84665 ! triacylglycerol 50:1 [Term] id: CHEBI:75690 name: (8R)-hydroxy-(11R,12R)-epoxyicosa-(5Z,9E,14Z)-trienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:75692 name: (8R)-hydroxy-(11S,12S)-epoxyicosa-(5Z,9E,14Z)-trienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:75696 name: (10R)-hydroxy-(11S,12S)-epoxyicosa-(5Z,8Z,14Z)-trienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:7570 name: nigerose subset: chebi_ph7_3 is_a: CHEBI:24405 ! glycosylglucose [Term] id: CHEBI:75700 name: (13R)-hydroxy-(14S,15S)-epoxyicosa-(5Z,8Z,11Z)-trienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:75703 name: (R)-mecoprop is_a: CHEBI:75704 ! 2-(4-chloro-2-methylphenoxy)propanoic acid relationship: has_role CHEBI:60575 ! phenoxy herbicide [Term] id: CHEBI:75704 name: 2-(4-chloro-2-methylphenoxy)propanoic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:83403 ! monochlorobenzenes [Term] id: CHEBI:75705 name: D-glucosaminic acid 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75712 name: (S)-mecoprop is_a: CHEBI:75704 ! 2-(4-chloro-2-methylphenoxy)propanoic acid [Term] id: CHEBI:75714 name: dUMP residue is_a: CHEBI:50298 ! canonical deoxyribonucleotide residue [Term] id: CHEBI:75717 name: (3R,4R)-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:75728 name: 1-stearoyl-2-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:75729 name: 1-stearoyl-2-arachidonoyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol [Term] id: CHEBI:75730 name: carminomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:64678 ! anthracycline cation [Term] id: CHEBI:75735 name: 1,3-dioleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:134567 ! diacylglycerol (18:1/0:0/18:1) is_a: CHEBI:47777 ! 1,3-diglyceride is_a: CHEBI:75945 ! dioleoylglycerol [Term] id: CHEBI:75757 name: 1-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64683 ! 1-acyl-sn-glycerol is_a: CHEBI:75342 ! 1-oleoylglycerol [Term] id: CHEBI:75759 name: beta-L-glucoside is_a: CHEBI:60980 ! beta-glucoside is_a: CHEBI:71352 ! L-glucoside [Term] id: CHEBI:75763 name: eukaryotic metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:75767 name: animal metabolite is_a: CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:75768 name: mammalian metabolite is_a: CHEBI:75767 ! animal metabolite [Term] id: CHEBI:75769 name: B vitamin is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:27314 ! water-soluble vitamin (role) relationship: has_role CHEBI:50733 ! nutraceutical [Term] id: CHEBI:75771 name: mouse metabolite is_a: CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:75772 name: Saccharomyces cerevisiae metabolite is_a: CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:75787 name: prokaryotic metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:75790 name: kaempferol 7-O-beta-D-glucopyranoside is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:28802 ! flavonols is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:64634 ! kaempferol O-glucoside relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:75792 name: 1,2-diacyl-sn-glycero-3-phospho-1'-(3'-O-L-lysyl)-sn-glycerol(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:75793 name: 1,2-diacyl-sn-glycero-3-phospho-1'-(3'-O-L-alanyl)-sn-glycerol zwitterion subset: chebi_ph7_3 is_a: CHEBI:60524 ! 3-O-L-alanyl-1-O-phosphatidylglycerol zwitterion [Term] id: CHEBI:75799 name: 3-beta-D-glucosyl-1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:67150 ! beta-D-Glc-(1->3')-1,2-diacylglycerol [Term] id: CHEBI:75800 name: (2'->5')-dinucleotide is_a: CHEBI:47885 ! dinucleotide [Term] id: CHEBI:75819 name: 8-oxo-ETE is_a: CHEBI:61704 ! oxoicosatetraenoic acid [Term] id: CHEBI:75822 name: (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoic acid is_a: CHEBI:138138 ! epoxy(hydroxy)icosatrienoic acid [Term] id: CHEBI:75824 name: 2,3-dioleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:75945 ! dioleoylglycerol [Term] id: CHEBI:75825 name: (7R)-hydroxy-(5S,6S)-epoxy-(8Z,11Z,14Z)-icosatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:75831 name: (8E,10S)-10-hydroperoxy-8-octadecenoic acid is_a: CHEBI:134613 ! hydroperoxyoctadecenoic acid [Term] id: CHEBI:75833 name: (8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoic acid is_a: CHEBI:64008 ! (8E,12Z)-10-hydroperoxy-8,12-octadecadienoic acid [Term] id: CHEBI:75835 name: anti-anaemic agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:75837 name: phytyl diphosphate is_a: CHEBI:18187 ! (E)-3,7,11,15-tetramethylhexadec-2-en-1-yl diphosphate [Term] id: CHEBI:75838 name: phytyl phosphate is_a: CHEBI:16460 ! polyprenol phosphate [Term] id: CHEBI:75840 name: 2-keto-3-deoxy-L-galactonic acid is_a: CHEBI:24963 ! ketoaldonic acid is_a: CHEBI:33752 ! hexonic acid [Term] id: CHEBI:75841 name: 1,2,3-tripalmitoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:75844 name: 1,2,3-trilinoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:140883 ! TG(18:2/18:2/18:2) is_a: CHEBI:144774 ! linoleoyl containing 1,2,3-triacyl-sn-glycerol is_a: CHEBI:17855 ! triglyceride relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75845 name: 1,2,3-trilinolenoylglycerol subset: chebi_ph7_3 is_a: CHEBI:138346 ! triacylglycerol 54:9 [Term] id: CHEBI:75846 name: 1,3-dioleoyl-2-palmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:75847 name: 1-palmitoyl-2,3-dioleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol is_a: CHEBI:75848 ! 1,2-dioleoyl-3-palmitoylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:75848 name: 1,2-dioleoyl-3-palmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:75849 name: 1,3-dipalmitoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:194140 ! dipalmitoleoylglycerol is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:75850 name: 1,3-dilinoleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:138658 ! dilinoleoylglycerol is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:75851 name: (2S,3R)-capreomycidine is_a: CHEBI:24436 ! guanidines is_a: CHEBI:39447 ! pyrimidines is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83965 ! L-arginine derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75852 name: 1,3-dilinolenoylglycerol subset: chebi_ph7_3 is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:75853 name: 2,3-dipalmitoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:75854 name: 2,3-dilinoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:138658 ! dilinoleoylglycerol is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:75855 name: 2,3-dilinolenoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:75856 name: 3-methylfumaryl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:75860 name: (3R)-citramalyl-CoA is_a: CHEBI:15457 ! citramalyl-CoA [Term] id: CHEBI:75865 name: D-glucosaminic acid 6-phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:33772 ! gluconic acid derivative [Term] id: CHEBI:75867 name: 1-oleoyl-3-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75869 ! 1-oleoyl-3-palmitoylglycerol is_a: CHEBI:77272 ! 1,3-diacyl-sn-glycerol [Term] id: CHEBI:75868 name: 1-palmitoyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75869 ! 1-oleoyl-3-palmitoylglycerol is_a: CHEBI:77272 ! 1,3-diacyl-sn-glycerol is_a: CHEBI:85694 ! diacylglycerol 34:1 [Term] id: CHEBI:75869 name: 1-oleoyl-3-palmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:7587 name: nitroalkane is_a: CHEBI:51129 ! nitrohydrocarbon [Term] id: CHEBI:75870 name: 2-palmitoyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:75876 name: (3R,4R)-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylic acid is_a: CHEBI:23468 ! cyclohexadienecarboxylic acid is_a: CHEBI:23469 ! cyclohexadienediol is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:75879 name: 4-O-(beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf)-cis-L-Hyp zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:75880 name: 4-O-(beta-L-Araf)-cis-L-Hyp zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:75882 name: 1-alkyl-2-acetylglycerol subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:75883 name: monoalkylglycerol is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:75884 name: N-acylindole is_a: CHEBI:24828 ! indoles is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:75885 name: 2-pyranones is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:37963 ! pyranone [Term] id: CHEBI:75890 name: 1,2-diacyl-sn-glycero-3-phospho-1'-(3'-O-L-alanyl)-sn-glycerol is_a: CHEBI:17511 ! 3-O-L-alanyl-1-O-phosphatidylglycerol [Term] id: CHEBI:75894 name: 4-O-(beta-L-Araf-(1->2)-beta-L-Araf-(1->2)-beta-L-Araf)-cis-L-Hyp is_a: CHEBI:21993 ! O(4)-glycosyl-L-hydroxyproline is_a: CHEBI:63571 ! trisaccharide derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:75895 name: N(alpha)-methyl-L-histidine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:75913 name: 2-arachidonyl glyceryl ether subset: chebi_ph7_3 is_a: CHEBI:67197 ! endocannabinoid is_a: CHEBI:75883 ! monoalkylglycerol is_a: CHEBI:76581 ! 2-alkylglycerol [Term] id: CHEBI:75914 name: 1-oleoyl-2-O-arachidonyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:75920 name: (R,R)-2-methyl-6-phytylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:75406 ! 2-methyl-6-phytylhydroquinone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75921 name: (R,R)-2,3-dimethyl-6-phytylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:75407 ! 2,3-dimethyl-6-phytylhydroquinone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75923 name: 3-oxodecanoate subset: chebi_ph7_3 is_a: CHEBI:133292 ! 3-oxo fatty acid anion [Term] id: CHEBI:75925 name: octadecanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:75926 name: 4-hydroxy-2-quinolone subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:74818 ! heteroaryl hydroxy compound [Term] id: CHEBI:75927 name: (R)-2-hydroxyhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:65097 ! 2-hydroxyhexadecanoate is_a: CHEBI:76177 ! (2R)-2-hydroxy fatty acid anion [Term] id: CHEBI:75928 name: (S)-2-hydroxyhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:65097 ! 2-hydroxyhexadecanoate [Term] id: CHEBI:75929 name: D-cycloserine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75931 name: 26-desglucoavenacoside B subset: chebi_ph7_3 is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63567 ! tetrasaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75932 name: 26-desglucoavenacoside A subset: chebi_ph7_3 is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63571 ! trisaccharide derivative is_a: CHEBI:70994 ! hexacyclic triterpenoid is_a: CHEBI:72600 ! spiroketal relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75933 name: 4-O-(beta-L-Araf)-cis-L-Hyp is_a: CHEBI:21993 ! O(4)-glycosyl-L-hydroxyproline is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84186 ! L-proline derivative [Term] id: CHEBI:75935 name: (R)-2-hydroxylignocerate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76177 ! (2R)-2-hydroxy fatty acid anion [Term] id: CHEBI:75936 name: 1-O-palmityl-2-acetyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:16291 ! 1-alkyl-2-acetyl-sn-glycerol is_a: CHEBI:75882 ! 1-alkyl-2-acetylglycerol [Term] id: CHEBI:75937 name: monooleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:87256 ! monoacylglycerol 18:1 [Term] id: CHEBI:75938 name: 3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64760 ! 3-acyl-sn-glycerol is_a: CHEBI:75342 ! 1-oleoylglycerol [Term] id: CHEBI:75945 name: dioleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:75946 name: cytochalasan alkaloid is_a: CHEBI:22315 ! alkaloid is_a: CHEBI:23528 ! cytochalasin relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:75947 name: 2'-3'-cGAMP is_a: CHEBI:47037 ! cyclic purine dinucleotide is_a: CHEBI:61295 ! guanyl ribonucleotide is_a: CHEBI:61296 ! adenyl ribonucleotide [Term] id: CHEBI:75950 name: (20S)-protopanaxadiol subset: chebi_ph7_3 is_a: CHEBI:76238 ! protopanaxadiol [Term] id: CHEBI:75951 name: protopanaxatriol subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:26606 ! sapogenin is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:75953 name: devancoaminyl vancomycin zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:75954 name: vancomycin aglycone zwitterion is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:75956 name: beta-D-galactosylceramide sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:83875 ! N-acyl-(3-O-sulfo-D-galactosyl)sphingosine(1-) [Term] id: CHEBI:75957 name: dTDP-beta-L-4-epi-vancosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:75963 name: chloroorienticin B(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:75967 name: nicotinate-adenine dinucleotide phosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75970 name: 2'-phospho-cyclic ADP-ribose(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:75972 name: (R)-2-hydroxyhexadecanoic acid is_a: CHEBI:65101 ! 2-hydroxyhexadecanoic acid [Term] id: CHEBI:75977 name: (S)-2-hydroxyhexadecanoic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:65101 ! 2-hydroxyhexadecanoic acid [Term] id: CHEBI:75989 name: alpha-D-glucosamine 6-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58725 ! 2-ammonio-2-deoxy-D-glucopyranose 6-phosphate(1-) [Term] id: CHEBI:75990 name: 2'-capryloylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75992 name: phenyl 5-phosphonato-alpha-D-ribofuranoside(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:75993 name: 2-capryloyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75994 name: 2'-palmitoylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75995 name: 2'-arachidonoylcardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:62237 ! cardiolipin(2-) [Term] id: CHEBI:75996 name: 2-arachidonoyl-2'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:75999 name: (S)-laudanine(1+) subset: chebi_ph7_3 is_a: CHEBI:76102 ! laudanine(1+) [Term] id: CHEBI:76001 name: (R)-laudanine(1+) subset: chebi_ph7_3 is_a: CHEBI:76102 ! laudanine(1+) [Term] id: CHEBI:76024 name: dotriacontanoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion [Term] id: CHEBI:76032 name: 7(1)-hydroxychlorophyll a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:28966 ! chlorophyll [Term] id: CHEBI:76036 name: (R)-2-hydroxylignoceric acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid [Term] id: CHEBI:76042 name: aromatic amino-acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:76044 name: omega-hydroxytriacontanoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:147288 ! omega-hydroxy-ultra-long-chain fatty acid anion [Term] id: CHEBI:76054 name: 1-O-oleoyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76055 name: 1-palmityl-2-acetyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol [Term] id: CHEBI:76056 name: dTDP-beta-L-4-epi-vancosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:76058 name: chloroorienticin B is_a: CHEBI:24396 ! glycopeptide is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37407 ! cyclic ether is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:76061 name: 1-O-palmitylglycerol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:76062 name: 1-O-palmityl-3-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:76225 ! 1-alkyl-3-acylglycerol [Term] id: CHEBI:76063 name: 1-O-palmityl-2-O-methyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:84473 ! 1-alkyl-2-methyl-sn-glycerol [Term] id: CHEBI:76064 name: 1-palmityl-2-methyl-3-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:76065 name: 1-oleoyl-2-palmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:76068 name: N,O-dioleoylethanolamine subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:84481 ! N,O-diacylethanolamine [Term] id: CHEBI:76070 name: O-oleoylanandamide subset: chebi_ph7_3 is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:76071 name: 2-oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:76083 ! oleoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:76072 name: nicotinic acid-adenine dinucleotide phosphate is_a: CHEBI:37584 ! nicotinic acid dinucleotide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:38807 ! calcium channel agonist relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:76073 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66857 ! phosphatidylcholine 36:1 [Term] id: CHEBI:76074 name: 1-O-stearoyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76076 name: 2-stearoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:91299 ! lysophosphatidylcholine(0:0/18:0) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76077 name: 1-O-palmitoyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76078 name: 2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:91297 ! lysophosphatidylcholine(0:0/16:0) [Term] id: CHEBI:76079 name: 2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:91303 ! lysophosphatidylcholine(0:0/20:4) [Term] id: CHEBI:76080 name: 1-O-arachidonoyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76081 name: 2'-phospho-cyclic ADP-ribose is_a: CHEBI:25609 ! nucleotide-sugar is_a: CHEBI:36982 ! cyclic purine nucleotide relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:38807 ! calcium channel agonist relationship: has_role CHEBI:62488 ! signalling molecule [Term] id: CHEBI:76083 name: oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64566 ! lysophosphatidylcholine 18:1 is_a: CHEBI:84465 ! acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:76084 name: 2-linoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:140444 ! linoleoyl-sn-glycero-3-phosphocholine is_a: CHEBI:91302 ! lysophosphatidylcholine(0:0/18:2) [Term] id: CHEBI:76085 name: 2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:131987 ! 2-docosahexaenoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:76086 name: 1-O-linoleoyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76087 name: 1-O-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:84483 ! 1-O-acyl-N-acetylsphingosine [Term] id: CHEBI:76088 name: 2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145434 ! oleoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72388 ! lysophosphatidylethanolamine zwitterion 18:1 [Term] id: CHEBI:76090 name: 2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72389 ! lysophosphatidylethanolamine zwitterion 18:2 [Term] id: CHEBI:76091 name: 2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:65213 ! 2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:76099 name: phenyl 5-phosphono-alpha-D-ribofuranoside is_a: CHEBI:35159 ! ribose monophosphate is_a: CHEBI:35312 ! pentoside is_a: CHEBI:74864 ! ribose derivative [Term] id: CHEBI:76101 name: (S)-laudanine is_a: CHEBI:76103 ! laudanine [Term] id: CHEBI:76102 name: laudanine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76103 name: laudanine is_a: CHEBI:22750 ! benzylisoquinoline alkaloid is_a: CHEBI:26901 ! benzyltetrahydroisoquinoline is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether [Term] id: CHEBI:76104 name: kaempferol 3-O-beta-D-galactoside(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:76105 name: (R)-laudanine is_a: CHEBI:76103 ! laudanine [Term] id: CHEBI:76106 name: rac-laudanosoline is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:76101 ! (S)-laudanine relationship: has_part CHEBI:76105 ! (R)-laudanine [Term] id: CHEBI:76150 name: (R)-2-hydroxy-alpha-linolenate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76177 ! (2R)-2-hydroxy fatty acid anion [Term] id: CHEBI:76151 name: (8Z,11Z,14Z)-heptadecatrienal subset: chebi_ph7_3 is_a: CHEBI:72692 ! polyunsaturated fatty aldehyde relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76152 name: (8Z,11Z,14Z)-heptadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76159 name: tetracenomycin F2(1-) is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:76161 name: (R)-2-hydroperoxy-alpha-linolenate subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate is_a: CHEBI:147340 ! (2R)-2-hydroperoxy fatty acid anion [Term] id: CHEBI:76166 name: 1,2-diacyl-3-O-[alpha-D-glucosyl-(1-> 2)-alpha-D-glucosyl]-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:63788 ! alpha-D-Glc-(1->2)-alpha-D-Glc-(1->3')-1,2-diacylglycerol [Term] id: CHEBI:76168 name: 1-alkyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:77578 ! monoalkyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:78202 ! 1-alkylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:76170 name: olefinic phospholipid is_a: CHEBI:16247 ! phospholipid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:76171 name: 1-acyl-2-(10-methylenealkanoyl)-sn-3-glycerophospholipid subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76176 name: 2-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:58896 ! 2-hydroxy carboxylate is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:76177 name: (2R)-2-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:58314 ! (2R)-2-hydroxy monocarboxylic acid anion is_a: CHEBI:76176 ! 2-hydroxy fatty acid anion [Term] id: CHEBI:76179 name: O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:76180 name: arachidonoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76184 name: alpha-linolenoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76185 name: stearidonoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76186 name: linoleoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76187 name: gamma-linolenoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76189 name: timnodonoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76194 name: palmitoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76195 name: sapienoyl bioconjugate subset: chebi_ph7_3 is_a: CHEBI:64985 ! bioconjugate [Term] id: CHEBI:76197 name: sapienate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:78095 ! hexadecenoate [Term] id: CHEBI:76202 name: riboflavin cyclic 4',5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:76206 name: xenobiotic metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:7621 name: norajmaline is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:76215 name: dotriacontanoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76220 name: omega-hydroxytriacontanoic acid is_a: CHEBI:147297 ! omega-hydroxy-ultra-long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:76222 name: 1-O-acyl-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:133444 ! 1-O-acylceramide is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:76224 name: aromatic ketone is_a: CHEBI:17087 ! ketone [Term] id: CHEBI:76225 name: 1-alkyl-3-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:24353 ! glycerol ether is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76578 ! diradylglycerol is_a: CHEBI:76582 ! monoalkylmonoacylglycerol [Term] id: CHEBI:76226 name: N-hexanoyldihydroceramide subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:76231 name: 2-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:28936 ! 2-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64575 ! lysophosphatidylethanolamine 18:1 [Term] id: CHEBI:76233 name: 2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:131745 ! lysophosphatidylethanolamine (0:0/18:2) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76234 name: (R)-2-hydroxy-alpha-linolenic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:72804 ! HOTrE [Term] id: CHEBI:76235 name: (8Z,11Z,14Z)-heptadecatrienoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid is_a: CHEBI:73155 ! trienoic fatty acid [Term] id: CHEBI:76236 name: (R)-2-hydroperoxy-alpha-linolenic acid is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid is_a: CHEBI:147344 ! (2R)-hydroperoxy fatty acid [Term] id: CHEBI:76238 name: protopanaxadiol subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:26606 ! sapogenin is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:76241 name: O-(S-acylpantetheine-4'-phosphoryl)serine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:76242 name: O-(S-acylpantetheine-4'-phosphoryl)serine is_a: CHEBI:51277 ! thioester is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84135 ! L-serine derivative [Term] id: CHEBI:76244 name: sapienic acid is_a: CHEBI:24548 ! hexadecenoic acid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:50748 ! antipsoriatic [Term] id: CHEBI:76245 name: 4-hydroxy-5-methyl-2-methylenefuran-3-one subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33823 ! enol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone [Term] id: CHEBI:76246 name: 2-methyl-5-methylenefuran-3,4-dione subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:51869 ! alpha-diketone [Term] id: CHEBI:76247 name: 4-hydroxy-2,5-dimethylfuran-3-one subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33823 ! enol is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:76248 name: 4-hydroxy-2,5-dimethylfuran-3-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:76250 name: hydroxyisoflavans is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:72572 ! isoflavans [Term] id: CHEBI:76251 name: 1-O-alkyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60520 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:76253 name: dTDP-4-dehydro-6-deoxy-alpha-D-gulose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76264 name: 1,2-diacyl-3-O-(beta-D-Glc-(1->6)-beta-D-Glc)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:63786 ! beta-D-Glc-(1->6)-beta-D-Glc-(1->3')-1,2-diacylglycerol [Term] id: CHEBI:76265 name: 1,2-diacyl-3-O-(beta-D-Glc-(1->6)-beta-D-Glc-(1->6)-beta-D-Glc)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63427 ! glycosylglycerol derivative [Term] id: CHEBI:76270 name: cyclohex-1-ene-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:76271 name: cyclohexane-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:76272 name: kaempferol 3-O-beta-D-xyloside(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:76273 name: dodecanedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76275 name: dTDP-alpha-D-fucofuranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76276 name: hexadecanedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76278 name: dehydrocoformycin(1+) subset: chebi_ph7_3 is_a: CHEBI:35286 ! iminium ion [Term] id: CHEBI:76279 name: 2''-O-acetyl-ADP-D-ribose is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:76280 name: dTDP-3-dehydro-4,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76281 name: tetradecanedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76282 name: suberate(2-) subset: chebi_ph7_3 is_a: CHEBI:132953 ! suberate is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) [Term] id: CHEBI:76283 name: sebacate(2-) subset: chebi_ph7_3 is_a: CHEBI:132954 ! sebacate is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76289 name: dTDP-4-dehydro-6-deoxy-alpha-D-gulose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:76291 name: nonanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76292 name: trans-2-nonenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76294 name: kaempferol 3-O-beta-D-xyloside is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76295 name: dTDP-alpha-D-fucofuranose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:76298 name: 22-oxodocosanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:71944 ! aldehydic acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:76299 name: docosanedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) [Term] id: CHEBI:763 name: algestone subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:36838 ! 17-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:59826 ! progestin [Term] id: CHEBI:76301 name: inositol phosphate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:76304 name: 22-hydroxydocosanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:76305 name: 26-hydroxyhexacosanoate subset: chebi_ph7_3 is_a: CHEBI:176542 ! omega-hydroxy-very-long-chain fatty acid anion [Term] id: CHEBI:76306 name: (+)-menthol subset: chebi_ph7_3 is_a: CHEBI:25187 ! p-menthan-3-ol [Term] id: CHEBI:76307 name: omega-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:76308 name: tetradecanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76309 name: omega-oxo fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59836 ! oxo fatty acid anion [Term] id: CHEBI:76311 name: 26-oxohexacosanoate subset: chebi_ph7_3 is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:76312 name: hexacosanedioate(2-) subset: chebi_ph7_3 is_a: CHEBI:133291 ! saturated dicarboxylic acid dianion(2-) [Term] id: CHEBI:76314 name: trans-2-nonenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:76315 name: dodecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:76316 name: decanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:76317 name: octanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:76318 name: 22-oxodocosanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:76319 name: docosanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76322 name: 22-hydroxydocosanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76325 name: 26-hydroxyhexacosanoic acid is_a: CHEBI:194304 ! omega-hydroxy-very-long-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76327 name: adipoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) [Term] id: CHEBI:76328 name: omega-oxo fatty acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:59644 ! oxo fatty acid [Term] id: CHEBI:76330 name: trans-2-octenedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76332 name: 26-oxohexacosanoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:76333 name: (S)-3-hydroxyoctanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76334 name: hexacosanedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid [Term] id: CHEBI:76335 name: 3-oxooctanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76339 name: dodecanedioyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:76340 name: trans-2-dodecenedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76342 name: (S)-3-hydroxydodecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76345 name: decanedioyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:76346 name: 3-oxododecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76347 name: trans-2-decenedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76348 name: (S)-3-hydroxydecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76349 name: 3-oxodecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:76352 name: octanedioyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:76356 name: (3S,6Z,9Z,12Z,15Z,18Z,21Z)-3-hydroxytetracosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:76360 name: (2E,6Z,9Z,12Z,15Z,18Z,21Z)-tetracosaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76364 name: (2E,6Z,9Z,12Z,15Z,18Z)-tetracosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76366 name: (3S,6Z,9Z,12Z,15Z,18Z)-3-hydroxytetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:76367 name: (6Z,9Z,12Z,15Z,18Z)-3-oxotetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76368 name: (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76373 name: (R)-3-hydroxyicosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:71455 ! 3-hydroxyicosanoyl-CoA(4-) [Term] id: CHEBI:76374 name: (R)-3-hydroxystearoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:71408 ! 3-hydroxyoctadecanoyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76375 name: (R)-3-hydroxydocosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:71456 ! 3-hydroxydocosanoyl-CoA(4-) [Term] id: CHEBI:76377 name: (3R)-3-hydroxytetracosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76378 name: (R)-3-hydroxyhexacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76382 name: (R)-3-hydroxyoctacosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76383 name: trans-2-octacosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76384 name: (R)-3-hydroxytriacontanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76385 name: trans-2-triacontenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76386 name: triacontanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76387 name: (3R,11Z)-3-hydroxyicosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76388 name: (2E,11Z)-icosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76389 name: (3R,13Z)-3-hydroxydocosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76391 name: (2E,13Z)-docosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76392 name: (3R,15Z)-3-hydroxytetracosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76393 name: (2E,15Z)-tetracosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76408 name: (3R,11Z,14Z)-3-hydroxyicosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76409 name: (2E,11Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76410 name: (11Z,14Z)-icosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:76411 name: (3R,8Z,11Z,14Z)-3-hydroxyicosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76412 name: (2E,8Z,11Z,14Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76413 name: greenhouse gas is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:76414 name: propellant is_a: CHEBI:33232 ! application [Term] id: CHEBI:76415 name: (3R,7Z,10Z,13Z,16Z)-3-hydroxydocosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76416 name: (2E,7Z,10Z,13Z,16Z)-docosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76417 name: (3R,9Z,12Z,15Z,18Z)-3-hydroxytetracosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:76418 name: (2E,9Z,12Z,15Z,18Z)-tetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76419 name: (11Z,14Z,17Z,20Z)-3-oxohexacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:90725 ! very long-chain 3-oxoacyl-CoA(4-) [Term] id: CHEBI:76420 name: (3R,11Z,14Z,17Z,20Z)-3-hydroxyhexacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:76421 name: (2E,11Z,14Z,17Z,20Z)-hexacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76422 name: (3R,13Z,16Z,19Z,22Z)-3-hydroxyoctacosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76423 name: trans-2-octenedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76424 name: quercetin O-glycoside is_a: CHEBI:50018 ! glycosyloxyflavone [Term] id: CHEBI:76425 name: (S)-3-hydroxyoctanedioyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:76426 name: 3-oxooctanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76427 name: trans-2-dodecenedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76428 name: (2E,13Z,16Z,19Z,22Z)-octacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76429 name: (S)-3-hydroxydodecanedioyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:76430 name: (3R,15Z,18Z,21Z,24Z)-3-hydroxytriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76431 name: (2E,15Z,18Z,21Z,24Z)-triacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76432 name: (3R,17Z,20Z,23Z,26Z)-3-hydroxydotriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76434 name: (2E,17Z,20Z,23Z,26Z)-dotriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76435 name: (3R,19Z,22Z,25Z,28Z)-3-hydroxytetratriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76436 name: (2E,19Z,22Z,25Z,28Z)-tetratriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76437 name: (3R,21Z,24Z,27Z,30Z)-3-hydroxyhexatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76438 name: (2E,21Z,24Z,27Z,30Z)-hexatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76439 name: 3-oxododecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76440 name: (3R,23Z,26Z,29Z,32Z)-3-hydroxyoctatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76441 name: (2E,23Z,26Z,29Z,32Z)-octatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76442 name: (23Z,26Z,29Z,32Z)-octatriacontatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:76443 name: trans-2-decenedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76444 name: (S)-3-hydroxydecanedioyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:76445 name: 3-oxodecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:76446 name: (3S,6Z,9Z,12Z,15Z,18Z,21Z)-3-hydroxytetracosahexaenoyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76447 name: (2E,6Z,9Z,12Z,15Z,18Z)-tetracosahexaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76448 name: (3S,6Z,9Z,12Z,15Z,18Z)-3-hydroxytetracosapentaenoyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76449 name: (6Z,9Z,12Z,15Z,18Z)-3-oxotetracosapentaenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76450 name: (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl-CoA is_a: CHEBI:149502 ! (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:76452 name: dialuric acid is_a: CHEBI:22693 ! barbiturates [Term] id: CHEBI:76453 name: (R)-3-hydroxyicosanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76454 name: (R)-3-hydroxystearoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76455 name: (3R,11Z,14Z,17Z)-3-hydroxyicosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76456 name: (2E,11Z,14Z,17Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76457 name: (3R,8Z,11Z,14Z,17Z)-3-hydroxyicosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76458 name: (2E,8Z,11Z,14Z,17Z)-icosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76459 name: (R)-3-hydroxybehenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76460 name: (3R,7Z,10Z,13Z,16Z,19Z)-3-hydroxydocosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76461 name: (2E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76462 name: (3R,9Z,12Z,15Z,18Z,21Z)-3-hydroxytetracosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:76463 name: (3R)-3-hydroxytetracosanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76464 name: (2E,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76465 name: (R)-3-hydroxyhexacosanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76466 name: (3R,11Z,14Z,17Z,20Z,23Z)-3-hydroxyhexacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:76467 name: (2E,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76468 name: (3R,13Z,16Z,19Z,22Z,25Z)-3-hydroxyoctacosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76469 name: (2E,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76470 name: (3R,15Z,18Z,21Z,24Z,27Z)-3-hydroxytriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76471 name: (2E,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76472 name: (R)-3-hydroxyoctacosanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA [Term] id: CHEBI:76473 name: (3R,17Z,20Z,23Z,26Z,29Z)-3-hydroxydotriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76474 name: (2E,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76475 name: (3R,19Z,22Z,25Z,28Z,31Z)-3-hydroxytetratriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76476 name: (2E,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76477 name: (3R,21Z,24Z,27Z,30Z,33Z)-3-hydroxyhexatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76478 name: dibutyrin subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride is_a: CHEBI:30879 ! alcohol is_a: CHEBI:50477 ! butyrate ester is_a: CHEBI:51307 ! diester [Term] id: CHEBI:76479 name: (2E,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76481 name: (3R,23Z,26Z,29Z,32Z,35Z)-3-hydroxyoctatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76483 name: (2E,23Z,26Z,29Z,32Z,35Z)-octatriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76484 name: (23Z,26Z,29Z,32Z,35Z)-octatriacontapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:76485 name: (R)-3-hydroxytriacontanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA [Term] id: CHEBI:76490 name: trans-octacos-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:76491 name: (3R,8Z,11Z,14Z,17Z,20Z,23Z)-hydroxyhexacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:76492 name: trans-2-triacontenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:76493 name: (2E,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76494 name: (3R,10Z,13Z,16Z,19Z,22Z,25Z)-3-hydroxyoctacosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:76495 name: (2E,10Z,13Z,16Z,19Z,22Z,25Z)-octacosaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76496 name: (3R,12Z,15Z,18Z,21Z,24Z,27Z)-3-hydroxytriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:76497 name: (2E,12Z,15Z,18Z,21Z,24Z,27Z)-triacontaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76498 name: coral metabolite is_a: CHEBI:75767 ! animal metabolite is_a: CHEBI:76507 ! marine metabolite [Term] id: CHEBI:76500 name: triacontanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA [Term] id: CHEBI:76502 name: (3R,14Z,17Z,20Z,23Z,26Z,29Z)-3-hydroxydotriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76503 name: monobutyrin subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:76504 name: (2E,14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76505 name: (3R,16Z,19Z,22Z,25Z,28Z,31Z)-3-hydroxytetratriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76506 name: (2E,16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76507 name: marine metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:76508 name: (3R,11Z)-3-hydroxyicosenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76509 name: (2E,11Z)-icosadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76511 name: (3R,13Z)-3-hydroxydocosenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76513 name: (3R,18Z,21Z,24Z,27Z,30Z,33Z)-3-hydroxyhexatriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76514 name: (2E,18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76515 name: (18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:76520 name: (2E,13Z)-docosadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76522 name: (3R,15Z)-3-hydroxytetracosenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76523 name: (2E,15Z)-tetracosadienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76524 name: (3R,11Z,14Z)-3-hydroxyicosadienoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76526 name: 6-oxocyclohex-1-ene-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:76527 name: 2-hydroxy-6-oxocyclohexane-1-carbonyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:76529 name: glycerophosphoglycerophosphoglycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76530 name: sn-glycero-3-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:76532 name: (2E,11Z,14Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76533 name: NDP-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76534 name: (11Z,14Z)-icosadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76535 name: [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:76536 name: (3R,8Z,11Z,14Z)-3-hydroxyicosatrienoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76538 name: (2E,8Z,11Z,14Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76539 name: [beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n (1-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:76541 name: (3R,7Z,10Z,13Z,16Z)-3-hydroxydocosatetraenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76542 name: (2E,7Z,10Z,13Z,16Z)-docosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76543 name: (3R,9Z,12Z,15Z,18Z)-3-hydroxytetracosatetraenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76545 name: 2-iminobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:76547 name: (2E,9Z,12Z,15Z,18Z)-tetracosapentaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76548 name: (11Z,14Z,17Z,20Z)-3-oxohexacosatetraenoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76549 name: (3R,11Z,14Z,17Z,20Z)-3-hydroxyhexacosatetraenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76550 name: (2E,11Z,14Z,17Z,20Z)-hexacosapentaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76552 name: (9Z,12Z)-hexadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76553 name: (3R,13Z,16Z,19Z,22Z)-3-hydroxyoctacosatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76554 name: (2E,13Z,16Z,19Z,22Z)-octacosapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76555 name: (11Z)-3-oxooctadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76556 name: (3R,15Z,18Z,21Z,24Z)-3-hydroxytriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76557 name: (3R,11Z)-3-hydroxyoctadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76558 name: (2E,11Z)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:76559 name: (13Z)-3-oxoicosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:76560 name: (2E,15Z,18Z,21Z,24Z)-triacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76561 name: (3R,13Z)-3-hydroxyicosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76562 name: (2E,13Z)-icosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76563 name: (13Z)-icosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:76564 name: (3R,17Z,20Z,23Z,26Z)-3-hydroxydotriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76565 name: 2-ammonioprop-2-enoate subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:76566 name: (2E,17Z,20Z,23Z,26Z)-dotriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76567 name: polyunsaturated fatty acid anion is_a: CHEBI:2580 ! unsaturated fatty acid anion [Term] id: CHEBI:76568 name: (3R,19Z,22Z,25Z,28Z)-3-hydroxytetratriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76569 name: (2E,19Z,22Z,25Z,28Z)-tetratriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76570 name: (3R,21Z,24Z,27Z,30Z)-3-hydroxyhexatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76571 name: (2E,21Z,24Z,27Z,30Z)-hexatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76575 name: monoradylglycerol is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:76578 name: diradylglycerol is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:76579 name: triradylglycerol is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:76581 name: 2-alkylglycerol subset: chebi_ph7_3 is_a: CHEBI:75883 ! monoalkylglycerol [Term] id: CHEBI:76582 name: monoalkylmonoacylglycerol is_a: CHEBI:137586 ! alkyl,acylglyceride is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:76583 name: alk-1-enylacylglycerol is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76578 ! diradylglycerol [Term] id: CHEBI:76585 name: 1-alkyl-2,3-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:36727 ! 1-alkyl-2,3-diacylglycerol [Term] id: CHEBI:76590 name: 1-organyl-2-lyso-sn-glycero-3-phospholipid(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76591 name: (25R)-cholest-5-ene-3beta,26-diol subset: chebi_ph7_3 is_a: CHEBI:17703 ! 26-hydroxycholesterol relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76592 name: (25R)-7alpha,26-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:18431 ! 7alpha,26-dihydroxycholesterol [Term] id: CHEBI:76593 name: 1-acyl-2-[(Z)-9,10-enoyl]-sn-glycero-3-phospholipid(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76594 name: 1-acyl-2-(9,10-methyleneacyl)-sn-glycero-3-phospholipid(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76595 name: nephroprotective agent is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:76596 name: ADP-alpha-D-ribose 1'',2''-cyclic phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:766 name: estriol 16-O-(beta-D-glucuronide) is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:76608 name: 2-iminopropionic acid is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33272 ! ketimine [Term] id: CHEBI:76610 name: omega-hydroxytetracosanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:76613 name: 3-hydroxypalmitate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:76614 name: 3-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:76615 name: 3,18-dihydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:76616 name: 3-hydroxylaurate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:76617 name: EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor is_a: CHEBI:38637 ! tyrosine kinase inhibitor is_a: CHEBI:76817 ! EC 2.7.10.* (protein-tyrosine kinase) inhibitor [Term] id: CHEBI:76618 name: 3,12-dihydroxylaurate subset: chebi_ph7_3 is_a: CHEBI:194241 ! omega-hydroxy-medium-chain fatty acid anion [Term] id: CHEBI:76619 name: omega-methyl fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:76621 name: (3R,23Z,26Z,29Z,32Z)-3-hydroxyoctatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76623 name: (2E,23Z,26Z,29Z,32Z)-octatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76624 name: 20-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76625 name: 11,12-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:131865 ! EET(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76626 name: (23Z,26Z,29Z,32Z)-octatriacontatetraenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76627 name: 19-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:76628 name: 11-hydroxylaurate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:76629 name: 2-lysophosphatidic acid is_a: CHEBI:132742 ! lysophosphatidic acid [Term] id: CHEBI:76631 name: 1-lysophosphatidic acid is_a: CHEBI:132742 ! lysophosphatidic acid [Term] id: CHEBI:76633 name: 17,18-EETeTr(1-) subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76634 name: 17(R),18(S)-EETeTr(1-) subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) is_a: CHEBI:76633 ! 17,18-EETeTr(1-) [Term] id: CHEBI:76635 name: 17(S),18(R)-EETeTr(1-) subset: chebi_ph7_3 is_a: CHEBI:131873 ! EpETE(1-) is_a: CHEBI:76633 ! 17,18-EETeTr(1-) [Term] id: CHEBI:76636 name: 19-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:84497 ! (omega-1)-hydroxy fatty acid anion [Term] id: CHEBI:76637 name: (3R,11Z,14Z,17Z)-3-hydroxyicosatrienoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76638 name: (2E,11Z,14Z,17Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76639 name: 20-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76640 name: (3R,8Z,11Z,14Z,17Z)-3-hydroxyicosatetraenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76641 name: (2E,8Z,11Z,14Z,17Z)-icosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76642 name: (3R,7Z,10Z,13Z,16Z,19Z)-3-hydroxydocosapentaenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76643 name: (2E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76644 name: (3R,9Z,12Z,15Z,18Z,21Z)-3-hydroxytetracosapentaenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76645 name: 20-oxoarachidonate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:76646 name: (2E,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76647 name: (5Z,8Z,11Z,14Z)-icosatetraenedioate subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:76650 name: (3R,11Z,14Z,17Z,20Z,23Z)-3-hydroxyhexacosapentaenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76651 name: (2E,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76652 name: (3R,13Z,16Z,19Z,22Z,25Z)-3-hydroxyoctacosapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76653 name: (2E,13Z,16Z,19Z,22Z,25Z)-octacosahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76654 name: (3R,15Z,18Z,21Z,24Z,27Z)-3-hydroxytriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76655 name: EC 2.1.* (C1-transferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76656 name: (2E,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76657 name: (3R,17Z,20Z,23Z,26Z,29Z)-3-hydroxydotriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76658 name: (2E,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76659 name: (3R,19Z,22Z,25Z,28Z,31Z)-3-hydroxytetratriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76660 name: EC 2.2.* (aldehyde or ketone transferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76661 name: EC 2.3.* (acyltransferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76662 name: EC 2.4.* (glycosyltransferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76663 name: EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor is_a: CHEBI:76834 ! EC 2.5.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:76664 name: (2E,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76665 name: EC 2.6.* (nitrogenous group transferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76666 name: (3R,21Z,24Z,27Z,30Z,33Z)-3-hydroxyhexatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76667 name: (2E,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76668 name: EC 2.7.* (P-containing group transferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76669 name: (3R,23Z,26Z,29Z,32Z,35Z)-3-hydroxyoctatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76670 name: (2E,23Z,26Z,29Z,32Z,35Z)-octatriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76671 name: (23Z,26Z,29Z,32Z,35Z)-octatriacontapentaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76672 name: (3R,8Z,11Z,14Z,17Z,20Z,23Z)-hydroxyhexacosahexaenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76673 name: (2E,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosaheptaenoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:76675 name: (3R,10Z,13Z,16Z,19Z,22Z,25Z)-3-hydroxyoctacosahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76678 name: (2E,10Z,13Z,16Z,19Z,22Z,25Z)-octacosaheptaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76679 name: (3R,12Z,15Z,18Z,21Z,24Z,27Z)-3-hydroxytriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76680 name: (2E,12Z,15Z,18Z,21Z,24Z,27Z)-triacontaheptaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76682 name: (3R,14Z,17Z,20Z,23Z,26Z,29Z)-3-hydroxydotriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76683 name: (2E,14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontaheptaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76684 name: (3R,16Z,19Z,22Z,25Z,28Z,31Z)-3-hydroxytetratriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76685 name: (2E,16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontaheptaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76686 name: (3R,18Z,21Z,24Z,27Z,30Z,33Z)-3-hydroxyhexatriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76687 name: (2E,18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontaheptaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76688 name: (18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76695 name: EC 5.4.* (intramolecular transferase) inhibitor is_a: CHEBI:75596 ! EC 5.* (isomerase) inhibitor [Term] id: CHEBI:76697 name: EC 5.99.* (other isomerases) inhibitor is_a: CHEBI:75596 ! EC 5.* (isomerase) inhibitor [Term] id: CHEBI:76706 name: EC 6.1.* (C-O bond-forming ligase) inhibitor is_a: CHEBI:75603 ! EC 6.* (ligase) inhibitor [Term] id: CHEBI:76709 name: 3-hydroxyicosanoate subset: chebi_ph7_3 is_a: CHEBI:139194 ! hydroxy fatty acid anion 20:0 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:7671 name: O-acetylhomoserine is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:76710 name: EC 4.* (lyase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:76711 name: EC 4.1.* (C-C lyase) inhibitor is_a: CHEBI:76710 ! EC 4.* (lyase) inhibitor [Term] id: CHEBI:76712 name: EC 4.2.* (C-O lyase) inhibitor is_a: CHEBI:76710 ! EC 4.* (lyase) inhibitor [Term] id: CHEBI:76713 name: EC 4.3.* (C-N lyase) inhibitor is_a: CHEBI:76710 ! EC 4.* (lyase) inhibitor [Term] id: CHEBI:76714 name: EC 4.4.* (C-S lyase) inhibitor is_a: CHEBI:76710 ! EC 4.* (lyase) inhibitor [Term] id: CHEBI:76722 name: 2-hydroxybehenate subset: chebi_ph7_3 is_a: CHEBI:139195 ! 2-hydroxy fatty acid anion 22:0 is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:76723 name: 2-hydroxytetracosanoate subset: chebi_ph7_3 is_a: CHEBI:139197 ! 2-hydroxy fatty acid anion 24:0 is_a: CHEBI:58950 ! very long-chain fatty acid anion [Term] id: CHEBI:76724 name: 2-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:139191 ! 2-hydroxy fatty acid anion 18:0 is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76725 name: EC 1.* (oxidoreductase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:76726 name: EC 1.1.* (oxidoreductase acting on donor CH-OH group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76727 name: EC 1.2.* (oxidoreductase acting on donor aldehyde/oxo group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76728 name: 2-hydroxyhexacosanoate subset: chebi_ph7_3 is_a: CHEBI:139199 ! 2-hydroxy fatty acid anion 26:0 is_a: CHEBI:58950 ! very long-chain fatty acid anion [Term] id: CHEBI:76729 name: EC 1.3.* (oxidoreductase acting on donor CH-CH group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76730 name: EC 1.4.* (oxidoreductase acting on donor CH-NH2 group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76731 name: EC 1.5.* (oxidoreductase acting on donor CH-NH group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76732 name: 2-hydroxyarachidate subset: chebi_ph7_3 is_a: CHEBI:139193 ! 2-hydroxy fatty acid anion 20:0 [Term] id: CHEBI:76733 name: EC 1.6.* (oxidoreductase acting on NADH or NADPH) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76735 name: EC 1.8.* (oxidoreductase acting on sulfur group of donors) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76736 name: EC 1.9.* (oxidoreductase acting on donor heme group) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76737 name: EC 1.10.* (oxidoreductase acting on diphenols and related substances as donors) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76738 name: EC 1.11.* (oxidoreductase acting on peroxide as donors) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76740 name: EC 1.13.* [oxidoreductase acting on single donors with incorporation of molecular oxygen (oxygenases)] inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76741 name: EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76744 name: EC 1.17.* (oxidoreductase acting on CH or CH2) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76748 name: EC 1.21.* (oxidoreductase acting on X-H and Y-H to form an X-Y bond) inhibitor is_a: CHEBI:76725 ! EC 1.* (oxidoreductase) inhibitor [Term] id: CHEBI:76759 name: EC 3.* (hydrolase) inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:7676 name: O-butanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:50477 ! butyrate ester is_a: CHEBI:86490 ! C4-acylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:76760 name: EC 3.1.* (ester hydrolase) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:76761 name: EC 3.2.* (glycosylase) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:76764 name: EC 3.5.* (hydrolases acting on non-peptide C-N bonds) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:76770 name: EC 3.11.* (hydrolases acting on C-P bonds) inhibitor is_a: CHEBI:76759 ! EC 3.* (hydrolase) inhibitor [Term] id: CHEBI:76773 name: EC 3.1.1.* (carboxylic ester hydrolase) inhibitor is_a: CHEBI:76760 ! EC 3.1.* (ester hydrolase) inhibitor [Term] id: CHEBI:76775 name: EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor is_a: CHEBI:76760 ! EC 3.1.* (ester hydrolase) inhibitor [Term] id: CHEBI:76778 name: IMP residue is_a: CHEBI:50299 ! canonical ribonucleotide residue [Term] id: CHEBI:76779 name: EC 3.4.21.26 (prolyl oligopeptidase) inhibitor is_a: CHEBI:5924 ! EC 3.4.21.* (serine endopeptidase) inhibitor [Term] id: CHEBI:76782 name: EC 3.4.15.* (peptidyl-dipeptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:76785 name: EC 3.1.26.* (endoribonucleases producing 5'-phosphomonoesters) inhibitor is_a: CHEBI:76760 ! EC 3.1.* (ester hydrolase) inhibitor [Term] id: CHEBI:76787 name: EC 3.4.11.* (aminopeptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:76788 name: EC 3.4.14.* (dipeptidyl- and tripeptidyl-peptidases) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:76789 name: EC 2.4.1.* (hexosyltransferase) inhibitor is_a: CHEBI:76662 ! EC 2.4.* (glycosyltransferase) inhibitor [Term] id: CHEBI:76790 name: EC 2.4.2.* (pentosyltransferase) inhibitor is_a: CHEBI:76662 ! EC 2.4.* (glycosyltransferase) inhibitor [Term] id: CHEBI:76791 name: EC 3.1.27.* (endoribonucleases producing other than 5'-phosphomonoesters) inhibitor is_a: CHEBI:76760 ! EC 3.1.* (ester hydrolase) inhibitor [Term] id: CHEBI:76796 name: EC 3.4.22.* (cysteine endopeptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:76797 name: EC 2.5.1.18 (glutathione transferase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:76800 name: pikromycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76801 name: narbomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76802 name: 5-O-beta-D-mycaminosyltylactone(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76803 name: 5-O-beta-D-mycaminosyl-20-oxotylonolide(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76804 name: 5-O-mycaminosyltylonolide(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76807 name: EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor is_a: CHEBI:76764 ! EC 3.5.* (hydrolases acting on non-peptide C-N bonds) inhibitor [Term] id: CHEBI:76808 name: EC 3.5.2.* (non-peptide cyclic amide C-N hydrolase) inhibitor is_a: CHEBI:76764 ! EC 3.5.* (hydrolases acting on non-peptide C-N bonds) inhibitor [Term] id: CHEBI:76809 name: EC 3.5.4.* (non-peptide cyclic amidine C-N hydrolase) inhibitor is_a: CHEBI:76764 ! EC 3.5.* (hydrolases acting on non-peptide C-N bonds) inhibitor [Term] id: CHEBI:76810 name: demethyllactenocin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76811 name: EC 3.1.4.12 (sphingomyelin phosphodiesterase) inhibitor is_a: CHEBI:50218 ! EC 3.1.4.* (phosphoric diester hydrolase) inhibitor [Term] id: CHEBI:76812 name: EC 2.7.11.* (protein-serine/threonine kinase) inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:76814 name: dTDP-beta-L-mycarose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76815 name: EC 2.7.7.* (nucleotidyltransferase) inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:76817 name: EC 2.7.10.* (protein-tyrosine kinase) inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:76819 name: demethylmacrocin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76820 name: macrocin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76821 name: beta-D-Manp-(1->4)-D-GlcpNAc subset: chebi_ph7_3 is_a: CHEBI:22480 ! amino disaccharide is_a: CHEBI:22485 ! glucosamine oligosaccharide [Term] id: CHEBI:76823 name: EC 6.3.1.* (acid-ammonia/amine ligase) inhibitor is_a: CHEBI:75600 ! EC 6.3.* (C-N bond-forming ligase) inhibitor [Term] id: CHEBI:76824 name: EC 6.4.1.* (carboxylase) inhibitor is_a: CHEBI:75604 ! EC 6.4.* (C-C bond-forming ligase) inhibitor [Term] id: CHEBI:76825 name: cellobionate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:76829 name: EC 5.4.3.* (intramolecular transferase transferring amino groups) inhibitor is_a: CHEBI:76695 ! EC 5.4.* (intramolecular transferase) inhibitor [Term] id: CHEBI:76830 name: EC 5.99.1.* (miscellaneous isomerase) inhibitor is_a: CHEBI:76697 ! EC 5.99.* (other isomerases) inhibitor [Term] id: CHEBI:76831 name: EC 4.4.1.* (C-S lyase) inhibitor is_a: CHEBI:76714 ! EC 4.4.* (C-S lyase) inhibitor [Term] id: CHEBI:76832 name: EC 4.3.1.* (ammonia-lyase) inhibitor is_a: CHEBI:76713 ! EC 4.3.* (C-N lyase) inhibitor [Term] id: CHEBI:76834 name: EC 2.5.* (non-methyl-alkyl or aryl transferase) inhibitor is_a: CHEBI:71300 ! EC 2.* (transferase) inhibitor [Term] id: CHEBI:76835 name: EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor is_a: CHEBI:76726 ! EC 1.1.* (oxidoreductase acting on donor CH-OH group) inhibitor [Term] id: CHEBI:76836 name: EC 1.1.3.* (oxidoreductase acting on donor CH-OH group, oxygen as acceptor) inhibitor is_a: CHEBI:76726 ! EC 1.1.* (oxidoreductase acting on donor CH-OH group) inhibitor [Term] id: CHEBI:76837 name: EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor is_a: CHEBI:76740 ! EC 1.13.* [oxidoreductase acting on single donors with incorporation of molecular oxygen (oxygenases)] inhibitor [Term] id: CHEBI:76838 name: EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76839 name: dTDP-beta-L-vancosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:76840 name: EC 1.14.99.* (miscellaneous oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76841 name: EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76842 name: vancomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:76844 name: 7-deoxyloganate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:76845 name: EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76846 name: 7-deoxyloganetate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:76847 name: EC 1.14.16.* (oxidoreductase acting on paired donors, reduced pteridine as one donor, incorporating 1 atom of oxygen) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76848 name: EC 1.17.4.* (oxidoreductase acting on CH or CH2 with a disulfide as acceptor) inhibitor is_a: CHEBI:76744 ! EC 1.17.* (oxidoreductase acting on CH or CH2) inhibitor [Term] id: CHEBI:76849 name: 7-deoxyloganetin subset: chebi_ph7_3 is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38131 ! lactol is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:50563 ! iridoid monoterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:76851 name: isoxazolin-5-one subset: chebi_ph7_3 is_a: CHEBI:55373 ! isoxazoles [Term] id: CHEBI:76852 name: EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD(+) or NADP(+) as acceptor) inhibitor is_a: CHEBI:76727 ! EC 1.2.* (oxidoreductase acting on donor aldehyde/oxo group) inhibitor [Term] id: CHEBI:76853 name: EC 1.2.3.* (oxidoreductase acting on donor aldehyde/oxo group with oxygen as acceptor) inhibitor is_a: CHEBI:76727 ! EC 1.2.* (oxidoreductase acting on donor aldehyde/oxo group) inhibitor [Term] id: CHEBI:76855 name: 3-(5-oxoisoxazolin-2-yl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:76856 name: 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:76857 name: EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD(+) or NADP(+) as acceptor) inhibitor is_a: CHEBI:76729 ! EC 1.3.* (oxidoreductase acting on donor CH-CH group) inhibitor [Term] id: CHEBI:76861 name: EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor is_a: CHEBI:76730 ! EC 1.4.* (oxidoreductase acting on donor CH-NH2 group) inhibitor [Term] id: CHEBI:76863 name: EC 1.5.1.* (oxidoreductase acting on donor CH-NH group, NAD(+) or NADP(+) as acceptor) inhibitor is_a: CHEBI:76731 ! EC 1.5.* (oxidoreductase acting on donor CH-NH group) inhibitor [Term] id: CHEBI:76864 name: (2S,3S)-beta-methylphenylalanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:76866 name: EC 1.6.5.* (oxidoreductase acting on NADH or NADPH with a quinone or similar as acceptor) inhibitor is_a: CHEBI:76733 ! EC 1.6.* (oxidoreductase acting on NADH or NADPH) inhibitor [Term] id: CHEBI:76869 name: EC 1.8.1.* (oxidoreductase acting on sulfur group of donors, NAD(+) or NADP(+) as acceptor) inhibitor is_a: CHEBI:76735 ! EC 1.8.* (oxidoreductase acting on sulfur group of donors) inhibitor [Term] id: CHEBI:76870 name: EC 1.9.3.* (oxidoreductase acting on donor heme group, oxygen as acceptor) inhibitor is_a: CHEBI:76736 ! EC 1.9.* (oxidoreductase acting on donor heme group) inhibitor [Term] id: CHEBI:76871 name: EC 2.1.1.* (methyltransferases) inhibitor is_a: CHEBI:76655 ! EC 2.1.* (C1-transferase) inhibitor [Term] id: CHEBI:76872 name: 2-iminobutanoic acid is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:33272 ! ketimine [Term] id: CHEBI:76874 name: EC 2.1.2.* (hydroxymethyl-, formyl- and related transferases) inhibitor is_a: CHEBI:76655 ! EC 2.1.* (C1-transferase) inhibitor [Term] id: CHEBI:76876 name: EC 2.2.1.* (transketolase/transaldolase) inhibitor is_a: CHEBI:76660 ! EC 2.2.* (aldehyde or ketone transferase) inhibitor [Term] id: CHEBI:76878 name: EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor is_a: CHEBI:76661 ! EC 2.3.* (acyltransferase) inhibitor [Term] id: CHEBI:76879 name: EC 2.6.1.* (transaminase) inhibitor is_a: CHEBI:76665 ! EC 2.6.* (nitrogenous group transferase) inhibitor [Term] id: CHEBI:76881 name: EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor is_a: CHEBI:76668 ! EC 2.7.* (P-containing group transferase) inhibitor [Term] id: CHEBI:76882 name: EC 2.4.99.* (glycosyltransferases transferring other glycosyl groups) inhibitor is_a: CHEBI:76662 ! EC 2.4.* (glycosyltransferase) inhibitor [Term] id: CHEBI:76883 name: EC 3.11.1.* (hydrolases acting on C-P bonds of phosphono-acetaldehyde, -acetate, or -pyruvate) inhibitor is_a: CHEBI:76770 ! EC 3.11.* (hydrolases acting on C-P bonds) inhibitor [Term] id: CHEBI:76885 name: EC 3.4.23.* (aspartic endopeptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:76889 name: (9Z,12Z)-hexadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76891 name: EC 3.4.11.14 (cytosol alanyl aminopeptidase) inhibitor is_a: CHEBI:76787 ! EC 3.4.11.* (aminopeptidase) inhibitor [Term] id: CHEBI:76892 name: A47934(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:76893 name: EC 3.4.14.2 (dipeptidyl-peptidase II) inhibitor is_a: CHEBI:76788 ! EC 3.4.14.* (dipeptidyl- and tripeptidyl-peptidases) inhibitor [Term] id: CHEBI:76894 name: A41030A(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:76895 name: EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor is_a: CHEBI:73216 ! EC 3.6.* (hydrolases acting on acid anhydrides) inhibitor [Term] id: CHEBI:76896 name: (11Z)-3-oxooctadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:76898 name: EC 1.14.14.1 (unspecific monooxygenase) inhibitor is_a: CHEBI:76838 ! EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor [Term] id: CHEBI:769 name: 16-methoxytabersonine is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:65323 ! monoterpenoid indole alkaloid [Term] id: CHEBI:76900 name: (3R,11Z)-3-hydroxyoctadecenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:76902 name: EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor is_a: CHEBI:76741 ! EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor [Term] id: CHEBI:76904 name: (2E,11Z)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:76905 name: (13Z)-3-oxoicosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76906 name: EC 4.1.1.* (carboxy-lyase) inhibitor is_a: CHEBI:76711 ! EC 4.1.* (C-C lyase) inhibitor [Term] id: CHEBI:76907 name: EC 4.2.1.* (hydro-lyases) inhibitor is_a: CHEBI:76712 ! EC 4.2.* (C-O lyase) inhibitor [Term] id: CHEBI:76908 name: (3R,13Z)-3-hydroxyicosenoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76909 name: (2E,13Z)-icosadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:76910 name: (13Z)-icosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:76913 name: L-cysteinate group subset: chebi_ph7_3 is_a: CHEBI:90782 ! C-terminal proteinogenic amino-acid residue(1-) [Term] id: CHEBI:76915 name: N,N-dimethyl-L-alaniniumyl group is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:76921 name: pavine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76922 name: argemonine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:76924 name: plant metabolite is_a: CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:76928 name: 2,3-saturated fatty acid(1-) subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion is_a: CHEBI:83955 ! 2-saturated fatty acid anion [Term] id: CHEBI:76929 name: 2,3-saturated fatty acid is_a: CHEBI:35366 ! fatty acid [Term] id: CHEBI:76930 name: omega-hydroxytetracosanoic acid is_a: CHEBI:194304 ! omega-hydroxy-very-long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:76931 name: Ac-Asp-Glu(3-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:76932 name: pathway inhibitor is_a: CHEBI:23924 ! enzyme inhibitor [Term] id: CHEBI:76933 name: 3,18-dihydroxyoctadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:76934 name: 3,12-dihydroxylauric acid is_a: CHEBI:194303 ! omega-hydroxy-medium-chain fatty acid is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:76935 name: Ac-Asp-Glu-Glu(4-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:76937 name: 11-hydroxylauric acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76938 name: EC 3.6.4.* (hydrolases acting on ATP; involved in cellular and subcellular movement) inhibitor is_a: CHEBI:73216 ! EC 3.6.* (hydrolases acting on acid anhydrides) inhibitor [Term] id: CHEBI:76939 name: EC 3.6.4.10 (non-chaperonin molecular chaperone ATPase) inhibitor is_a: CHEBI:76938 ! EC 3.6.4.* (hydrolases acting on ATP; involved in cellular and subcellular movement) inhibitor [Term] id: CHEBI:76941 name: sphingoid 1-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:76942 name: beta-citrylglutamate(4-) subset: chebi_ph7_3 is_a: CHEBI:35754 ! tetracarboxylic acid anion is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:76943 name: (+)-copalol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76944 name: 13-epi-manool subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:76945 name: manool subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:76946 name: fungal metabolite is_a: CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:76948 name: ent-manool subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76950 name: (-)-ent-copalol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76952 name: syn-copalol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76953 name: 17(R),18(S)-EETeTr is_a: CHEBI:72853 ! 17(18)-EpETE [Term] id: CHEBI:76954 name: (13S)-vitexifolin A subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76955 name: 17(S),18(R)-EETeTr is_a: CHEBI:72853 ! 17(18)-EpETE [Term] id: CHEBI:76956 name: Aspergillus metabolite is_a: CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:76959 name: 19-HEPE is_a: CHEBI:72799 ! HEPE [Term] id: CHEBI:76962 name: 20-HEPE is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:72799 ! HEPE [Term] id: CHEBI:76964 name: Penicillium metabolite is_a: CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:76965 name: 20-oxoarachidonic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:76328 ! omega-oxo fatty acid [Term] id: CHEBI:76966 name: (5Z,8Z,11Z,14Z)-icosatetraenedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid is_a: CHEBI:36046 ! icosatetraenedioic acid [Term] id: CHEBI:76967 name: human xenobiotic metabolite is_a: CHEBI:76206 ! xenobiotic metabolite is_a: CHEBI:77746 ! human metabolite [Term] id: CHEBI:76968 name: fungal xenobiotic metabolite is_a: CHEBI:76206 ! xenobiotic metabolite is_a: CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:76969 name: bacterial metabolite is_a: CHEBI:75787 ! prokaryotic metabolite [Term] id: CHEBI:76971 name: Escherichia coli metabolite is_a: CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:76976 name: bacterial xenobiotic metabolite is_a: CHEBI:76206 ! xenobiotic metabolite is_a: CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:76978 name: trioctanoin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:87657 ! octanoate ester relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:76979 name: 1,2-dioctanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:88066 ! dioctanoylglycerol [Term] id: CHEBI:76980 name: 2-hydroxybehenic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:76981 name: 3-[(1-carboxylatovinyl)oxy]benzoate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:76982 name: 2,3-dioctanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:88066 ! dioctanoylglycerol [Term] id: CHEBI:76986 name: 2-hydroxyhexacosanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid [Term] id: CHEBI:76988 name: xenoestrogen is_a: CHEBI:138015 ! endocrine disruptor is_a: CHEBI:50114 ! estrogen [Term] id: CHEBI:76989 name: phytoestrogen is_a: CHEBI:50114 ! estrogen [Term] id: CHEBI:76990 name: mycoestrogen is_a: CHEBI:50114 ! estrogen [Term] id: CHEBI:76992 name: 2-hydroxyarachidic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid is_a: CHEBI:15904 ! long-chain fatty acid [Term] id: CHEBI:77000 name: 1-oleoyl-2-lauroyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:77001 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:64716 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) [Term] id: CHEBI:77002 name: methoxyisoflavan is_a: CHEBI:25698 ! ether is_a: CHEBI:72572 ! isoflavans [Term] id: CHEBI:77009 name: 5-O-beta-D-mycaminosyl-20-oxotylonolide is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:77011 name: 5-O-mycaminosyltylonolide is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:77015 name: (4Z,7Z,10Z,13Z,16Z,19Z)-22-hydroxydocosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:77016 name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:149500 ! (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative is_a: CHEBI:78060 ! docosahexaenoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77019 name: EC 1.10.99.* (oxidoreductases acting on diphenols and related substances as donors, other acceptors) inhibitor is_a: CHEBI:76737 ! EC 1.10.* (oxidoreductase acting on diphenols and related substances as donors) inhibitor [Term] id: CHEBI:77020 name: EC 1.10.99.2 [ribosyldihydronicotinamide dehydrogenase (quinone)] inhibitor is_a: CHEBI:77019 ! EC 1.10.99.* (oxidoreductases acting on diphenols and related substances as donors, other acceptors) inhibitor [Term] id: CHEBI:77021 name: cellobionic acid is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:36233 ! disaccharide relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77024 name: EC 3.1.3.41 (4-nitrophenylphosphatase) inhibitor is_a: CHEBI:76775 ! EC 3.1.3.* (phosphoric monoester hydrolase) inhibitor [Term] id: CHEBI:77027 name: 7-deoxyloganetic acid is_a: CHEBI:38606 ! cyclopentapyran is_a: CHEBI:50563 ! iridoid monoterpenoid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77029 name: 3-(5-oxoisoxazolin-2-yl)-L-alanine is_a: CHEBI:55373 ! isoxazoles is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77030 name: 3-(5-oxoisoxazolin-4-yl)-L-alanine is_a: CHEBI:55373 ! isoxazoles is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77031 name: (2S,3S)-beta-methylphenylalanine is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:77033 name: 14-hydroxymyristate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:77034 name: mucolytic is_a: CHEBI:23888 ! drug [Term] id: CHEBI:77035 name: expectorant is_a: CHEBI:23888 ! drug [Term] id: CHEBI:77036 name: A41030A is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25903 ! peptide antibiotic is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:37407 ! cyclic ether relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:77037 name: N,N-dimethyl-L-alanyl group subset: chebi_ph7_3 is_a: CHEBI:22487 ! alpha-aminoacyl group [Term] id: CHEBI:77038 name: (3S)-hydroxytetradecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77039 name: (2E)-tetradecenedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77041 name: 3-oxotetradecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77042 name: N,N-dimethyl-L-alanine is_a: CHEBI:25264 ! methyl-L-alanine [Term] id: CHEBI:77046 name: isopimarane subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:35662 ! terpenoid fundamental parent is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:77047 name: tylosin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77048 name: pavine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:77049 ! (R,R)-pavine relationship: has_part CHEBI:77050 ! (S,S)-pavine relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77049 name: (R,R)-pavine is_a: CHEBI:77051 ! 2,3,8,9-tetramethoxy-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene [Term] id: CHEBI:77050 name: (S,S)-pavine is_a: CHEBI:77051 ! 2,3,8,9-tetramethoxy-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene [Term] id: CHEBI:77051 name: 2,3,8,9-tetramethoxy-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50995 ! secondary amino compound [Term] id: CHEBI:77055 name: argemonine is_a: CHEBI:60911 ! racemate relationship: has_part CHEBI:77059 ! (+)-argemonine relationship: has_part CHEBI:80 ! (-)-argemonine [Term] id: CHEBI:77059 name: (+)-argemonine is_a: CHEBI:77060 ! 2,3,8,9-tetramethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene [Term] id: CHEBI:77060 name: 2,3,8,9-tetramethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene is_a: CHEBI:24921 ! isoquinoline alkaloid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:77061 name: 4,8-dimethylnonanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77063 name: 4,8-dimethylnonanoate subset: chebi_ph7_3 is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion [Term] id: CHEBI:77064 name: Ac-Asp-Glu-Glu is_a: CHEBI:47923 ! tripeptide [Term] id: CHEBI:77065 name: beta-citrylglutamic acid is_a: CHEBI:21650 ! N-acyl-L-glutamic acid is_a: CHEBI:35742 ! tetracarboxylic acid relationship: has_role CHEBI:38157 ! iron chelator relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77068 name: sphingoid 1-phosphate is_a: CHEBI:35786 ! phosphosphingolipid [Term] id: CHEBI:77073 name: rhodomycin D(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77074 name: 4-O-methylrhodomycin D(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77075 name: (2E)-hexadecenedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77076 name: 10-carboxy-13-deoxydaunorubicin zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77077 name: 10-carboxy-13-deoxycarminomycin zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77079 name: (3R)-hydroxyhexadecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77080 name: (3S)-hydroxyhexadecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77081 name: 3-oxohexadecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77084 name: tetradecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77085 name: hexadecanedioyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:77086 name: O-lauroyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:73054 ! O-dodecanoylcarnitine is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77087 name: O-hexadecanedioyl-L-carnitine(1-) subset: chebi_ph7_3 is_a: CHEBI:176910 ! fatty acyl-L-carnitine is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:77089 name: EC 2.5.1.49 (O-acetylhomoserine aminocarboxypropyltransferase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:77090 name: EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor is_a: CHEBI:76832 ! EC 4.3.1.* (ammonia-lyase) inhibitor [Term] id: CHEBI:77091 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74922 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77092 name: fenbendazole subset: chebi_ph7_3 is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:23003 ! carbamate ester is_a: CHEBI:35683 ! aryl sulfide relationship: has_role CHEBI:35444 ! antinematodal drug [Term] id: CHEBI:77093 name: 1-icosanoyl-2-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:77094 name: 1-icosanoyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74922 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77096 name: 1-palmitoyl-2-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:77097 name: 1-stearoyl-2-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:85701 ! diacylglycerol 36:2 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:77098 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74920 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77099 name: (2S)-pristanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:77102 name: EC 1.3.5.* (oxidoreductase acting on CH-CH of donor with a quinone or related compound as acceptor) inhibitor is_a: CHEBI:76729 ! EC 1.3.* (oxidoreductase acting on donor CH-CH group) inhibitor [Term] id: CHEBI:77107 name: 3-[(1-carboxyvinyl)oxy]benzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:47985 ! enol ether [Term] id: CHEBI:77108 name: EC 1.1.1.141 [15-hydroxyprostaglandin dehydrogenase (NAD(+))] inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:77109 name: EC 1.21.3.* (oxidoreductase acting on X-H and Y-H to form an X-Y bond, with oxygen as acceptor) inhibitor is_a: CHEBI:76748 ! EC 1.21.* (oxidoreductase acting on X-H and Y-H to form an X-Y bond) inhibitor [Term] id: CHEBI:77110 name: EC 1.21.3.3 (reticuline oxidase) inhibitor is_a: CHEBI:77109 ! EC 1.21.3.* (oxidoreductase acting on X-H and Y-H to form an X-Y bond, with oxygen as acceptor) inhibitor [Term] id: CHEBI:77111 name: EC 2.1.1.116 [3'-hydroxy-N-methyl-(S)-coclaurine 4'-O-methyltransferase] inhibitor is_a: CHEBI:76871 ! EC 2.1.1.* (methyltransferases) inhibitor [Term] id: CHEBI:77113 name: EC 2.7.11.10 (IkappaB kinase) inhibitor is_a: CHEBI:76812 ! EC 2.7.11.* (protein-serine/threonine kinase) inhibitor [Term] id: CHEBI:77115 name: EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor is_a: CHEBI:76871 ! EC 2.1.1.* (methyltransferases) inhibitor [Term] id: CHEBI:77117 name: EC 3.5.5.* (hydrolase acting on C-N bonds in nitriles) inhibitor is_a: CHEBI:76764 ! EC 3.5.* (hydrolases acting on non-peptide C-N bonds) inhibitor [Term] id: CHEBI:77118 name: EC 3.5.5.1 (nitrilase) inhibitor is_a: CHEBI:77117 ! EC 3.5.5.* (hydrolase acting on C-N bonds in nitriles) inhibitor [Term] id: CHEBI:77119 name: EC 1.1.1.189 (prostaglandin-E2 9-reductase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:77121 name: 1-oleoyl-2-lauroyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77122 name: 1-palmitoyl-2-lauroyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:64961 ! 1,2-diacyl-sn-glycero-3-phospho-(1'-sn-glycerol) is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77124 name: (4Z,7Z,10Z,13Z,16Z,19Z)-22-hydroxydocosahexaenoic acid is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:72790 ! hydroxydocosahexaenoic acid [Term] id: CHEBI:77125 name: 1,2-diarachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:147309 ! diarachidonoylglycerol is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:77126 name: 1,2-diarachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74922 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77127 name: 1,2-dilinoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:138658 ! dilinoleoylglycerol is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:77128 name: 1,2-dilinoleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:74920 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77129 name: 1-stearoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:38807 ! calcium channel agonist relationship: has_role CHEBI:64018 ! protein kinase C agonist [Term] id: CHEBI:77130 name: 1-stearoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:77131 name: sinapic acid is_a: CHEBI:24688 ! monohydroxycinnamic acid is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33853 ! phenols is_a: CHEBI:51681 ! dimethoxybenzene is_a: CHEBI:61407 ! methoxycinnamic acid [Term] id: CHEBI:77132 name: 6-sulfo-D-quinovose(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:77133 name: 6-deoxy-6-sulfo-D-fructofuranose(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:77134 name: 6-deoxy-6-sulfo-D-fructofuranose 1-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:77135 name: 3-sulfolactaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion [Term] id: CHEBI:77136 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 4-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58178 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) [Term] id: CHEBI:77137 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 4,5-biphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58456 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate(5-) [Term] id: CHEBI:77138 name: 3-sulfopropanediol(1-) subset: chebi_ph7_3 is_a: CHEBI:134249 ! alkanesulfonate oxoanion [Term] id: CHEBI:77139 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 4-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58178 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) [Term] id: CHEBI:77140 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 4,5-biphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:58456 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate(5-) [Term] id: CHEBI:77141 name: dTDP-beta-L-evernitrose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:77142 name: dTDP-2,3,6-trideoxy-3-C-methyl-4-O-methyl-3-nitroso-beta-L-arabino-hexopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:77143 name: dTDP-N-hydroxy-beta-L-evernosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:77144 name: dTDP-beta-L-evernosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:77146 name: ginsenoside C-K subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50857 ! anti-allergic agent relationship: has_role CHEBI:62868 ! hepatoprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77148 name: ginsenoside Re subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76595 ! nephroprotective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77149 name: notoginsenoside R1 subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:77150 name: ginsenoside F1 subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77152 name: ginsenoside Rb2 subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77156 name: gypenoside LXXV subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77157 name: ginsenoside C-Y subset: chebi_ph7_3 is_a: CHEBI:143563 ! 3beta-hydroxy-4,4-dimethylsteroid is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36847 ! 12beta-hydroxy steroid is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:74978 ! ginsenoside relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77158 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:65055 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:91036 ! phosphatidylinositol 36:3(1-) [Term] id: CHEBI:77159 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:77160 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:77163 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:65055 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:77164 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:77165 name: 1,2-dilinoleoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:75194 ! phosphatidylinositol 36:4(1-) [Term] id: CHEBI:77166 name: 3-oxo-Delta(1),Delta(4)-steroid subset: chebi_ph7_3 is_a: CHEBI:20156 ! 3-oxo-Delta(1) steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:77167 name: 1,2-dilinoleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:77168 name: 14-hydroxymyristic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid [Term] id: CHEBI:77169 name: (3S)-hydroxytetradecanedioyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:77170 name: (2E)-tetradecenedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77172 name: 3-oxotetradecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77178 name: histological dye is_a: CHEBI:37958 ! dye [Term] id: CHEBI:77179 name: 4-O-methylrhodomycin D is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:51285 ! acenoquinone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77181 name: crystal violet cation subset: chebi_ph7_3 is_a: CHEBI:35286 ! iminium ion relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:77182 name: food colouring is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:77183 name: (2E)-hexadecenedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77184 name: 1-palmityl-2-arachidonoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52595 ! 1-alkyl-2-acyl-sn-glycerol relationship: has_part CHEBI:25842 ! palmityl group [Term] id: CHEBI:77185 name: 1-palmityl-2-oleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52595 ! 1-alkyl-2-acyl-sn-glycerol relationship: has_part CHEBI:25842 ! palmityl group [Term] id: CHEBI:77186 name: 1-palmityl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73332 ! 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77187 name: 1-palmityl-2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73332 ! 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77189 name: (3R)-hydroxyhexadecanedioyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA [Term] id: CHEBI:7719 name: ochratoxin A is_a: CHEBI:25985 ! phenylalanine derivative is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:38762 ! isochromanes is_a: CHEBI:77673 ! N-acyl-L-phenylalanine relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:38215 ! calcium channel blocker relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:61015 ! nephrotoxin relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76964 ! Penicillium metabolite [Term] id: CHEBI:77190 name: CDP-dipalmitoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) [Term] id: CHEBI:77191 name: 3-oxohexadecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77194 name: EC 2.7.1.33 (pantothenate kinase) inhibitor is_a: CHEBI:76881 ! EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor [Term] id: CHEBI:77195 name: 10-carboxy-13-deoxydaunorubicin is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:49322 ! anthracycline antibiotic is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:77198 name: 6-sulfo-D-quinovose is_a: CHEBI:38029 ! carbohydrate sulfonate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77199 name: (3S)-hydroxyhexadecanedioyl-CoA is_a: CHEBI:15455 ! (S)-3-hydroxyacyl-CoA [Term] id: CHEBI:77200 name: (10E,12Z)-octadecadienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:77201 name: (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78052 ! tetracosapentaenoate [Term] id: CHEBI:77202 name: (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78056 ! tetracosahexaenoate [Term] id: CHEBI:77203 name: (11Z,14Z,17Z,20Z,23Z)-hexacosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78051 ! hexacosapentaenoate [Term] id: CHEBI:77205 name: (8Z,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78057 ! hexacosahexaenoate [Term] id: CHEBI:77206 name: (13Z,16Z,19Z,22Z,25Z)-octacosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78063 ! octacosapentaenoate [Term] id: CHEBI:77207 name: tetradecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77208 name: hexadecanedioyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:77211 name: (12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78080 ! triacontahexaenoate [Term] id: CHEBI:77212 name: (17Z,20Z,23Z,26Z,29Z)-dotriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78082 ! dotriacontapentaenoate [Term] id: CHEBI:77213 name: (14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78083 ! dotriacontahexaenoate [Term] id: CHEBI:77214 name: (19Z,22Z,25Z,28Z,31Z)-tetratriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78087 ! tetratriacontapentaenoate [Term] id: CHEBI:77215 name: (16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78088 ! tetratriacontahexaenoate [Term] id: CHEBI:77216 name: (21Z,24Z,27Z,30Z,33Z)-hexatriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78091 ! hexatriacontapentaenoate [Term] id: CHEBI:77217 name: (18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:78092 ! hexatriacontahexaenoate [Term] id: CHEBI:77218 name: (23Z,26Z,29Z,32Z,35Z)-octatriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78094 ! octatriacontapentaenoate [Term] id: CHEBI:77219 name: (9Z,12Z)-hexadecadienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78096 ! hexadecadienoate [Term] id: CHEBI:77220 name: (11Z,14Z)-icosadienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78073 ! icosadienoate [Term] id: CHEBI:77221 name: (17Z)-hexacosenoate subset: chebi_ph7_3 is_a: CHEBI:78055 ! hexacosenoate [Term] id: CHEBI:77222 name: (6Z,9Z,12Z,15Z)-octadecatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78050 ! octadecatetraenoate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77223 name: (11Z,14Z,17Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:78072 ! icosatrienoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77224 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:149499 ! (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative is_a: CHEBI:78053 ! docosapentaenoate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77225 name: all-cis-docosa-7,10,13,16-tetraenoate subset: chebi_ph7_3 is_a: CHEBI:149498 ! (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78069 ! docosatetraenoate [Term] id: CHEBI:77226 name: (4Z,7Z,10Z,13Z,16Z)-docosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:149502 ! (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78053 ! docosapentaenoate [Term] id: CHEBI:77227 name: (9Z,12Z,15Z,18Z)-tetracosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion is_a: CHEBI:78061 ! tetracosatetraenoate [Term] id: CHEBI:77228 name: (6Z,9Z,12Z,15Z,18Z)-tetracosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:78052 ! tetracosapentaenoate [Term] id: CHEBI:77229 name: (11Z,14Z,17Z,20Z)-hexacosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78054 ! hexacosatetraenoate [Term] id: CHEBI:77231 name: (13Z,16Z,19Z,22Z)-octacosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78062 ! octacosatetraenoate [Term] id: CHEBI:77232 name: (15Z,18Z,21Z,24Z)-triacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78079 ! triacontatetraenoate [Term] id: CHEBI:77233 name: (17Z,20Z,23Z,26Z)-dotriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78081 ! dotriacontatetraenoate [Term] id: CHEBI:77234 name: (19Z,22Z,25Z,28Z)-tetratriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78086 ! tetratriacontatetraenoate [Term] id: CHEBI:77235 name: (21Z,24Z,27Z,30Z)-hexatriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78089 ! hexatriacontatetraenoate [Term] id: CHEBI:77236 name: (23Z,26Z,29Z,32Z)-octatriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:78093 ! octatriacontatetraenoate [Term] id: CHEBI:77237 name: O-hexadecanedioyl-L-carnitine is_a: CHEBI:73081 ! O-(15-carboxypentadecanoyl)carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:77239 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:140354 ! phosphatidic acid 38:4 is_a: CHEBI:75112 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate [Term] id: CHEBI:77240 name: alpha-L-Fucp-(1->3)-[beta-D-Galp-(1->4)]-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:90379 ! beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer [Term] id: CHEBI:77241 name: 1-icosanoyl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:75112 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate [Term] id: CHEBI:77248 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate is_a: CHEBI:134237 ! phosphatidic acid 36:2 is_a: CHEBI:75110 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphate [Term] id: CHEBI:77250 name: pristanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:77251 name: (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:77252 name: 1,2-diarachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:75112 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate [Term] id: CHEBI:77253 name: tetraoleoyl cardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:72896 ! cardiolipin 72:4(2-) [Term] id: CHEBI:77254 name: 1,2-dilinoleoyl-sn-glycero-3-phosphate is_a: CHEBI:75110 ! 1-acyl-2-linoleoyl-sn-glycero-3-phosphate [Term] id: CHEBI:77255 name: EC 3.4.24.83 (anthrax lethal factor endopeptidase) inhibitor is_a: CHEBI:59107 ! EC 3.4.24.* (metalloendopeptidase) inhibitor [Term] id: CHEBI:77256 name: 1,1'-dioleyl 2,2'-dilysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:75137 ! 2,2'-dilysocardiolipin(2-) [Term] id: CHEBI:77257 name: (2S)-2-methylpentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77258 name: 1-stearoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphate is_a: CHEBI:140353 ! phosphatidic acid 40:6 is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:77259 name: trioleoyl 2-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:77261 name: 6-deoxy-6-sulfo-D-fructofuranose is_a: CHEBI:38029 ! carbohydrate sulfonate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77263 name: 6-deoxy-6-sulfo-D-fructofuranose 1-phosphate is_a: CHEBI:26816 ! carbohydrate phosphate is_a: CHEBI:38029 ! carbohydrate sulfonate relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77265 name: 3-sulfolactaldehyde is_a: CHEBI:26282 ! propanals is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:47901 ! alkanesulfonic acid [Term] id: CHEBI:77267 name: 3-sulfopropanediol is_a: CHEBI:26284 ! propane-1,2-diols is_a: CHEBI:47901 ! alkanesulfonic acid relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77268 name: pristanate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:83976 ! 2-methyl fatty acid anion [Term] id: CHEBI:77269 name: dTDP-beta-L-evernitrose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:77271 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 4-phosphate is_a: CHEBI:17526 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate [Term] id: CHEBI:77272 name: 1,3-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:77274 name: 1-alkyl-3-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:76225 ! 1-alkyl-3-acylglycerol [Term] id: CHEBI:77275 name: (2R)-pristanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:77276 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 4,5-biphosphate is_a: CHEBI:18348 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate [Term] id: CHEBI:77277 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 4-phosphate is_a: CHEBI:17526 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate [Term] id: CHEBI:77279 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 4,5-biphosphate is_a: CHEBI:18348 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate [Term] id: CHEBI:77280 name: dTDP-2,3,6-trideoxy-3-C-methyl-4-O-methyl-3-nitroso-beta-L-arabino-hexopyranose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:35800 ! nitroso compound [Term] id: CHEBI:77281 name: dTDP-N-hydroxy-beta-L-evernosamine is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:24709 ! hydroxylamines [Term] id: CHEBI:77283 name: 1-(Z)-alk-1-enyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:193594 ! 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid is_a: CHEBI:73325 ! 1-(alk-1-enyl)-sn-glycero-3-phosphate(2-) is_a: CHEBI:78171 ! monoalkenylglycero-3-phosphate(2-) is_a: CHEBI:78174 ! 1-(alk-1-enyl)-glycero-3-phosphate(2-) [Term] id: CHEBI:77284 name: 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73327 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:78183 ! 1-alkenyl-2-acyl-glycero-3-phosphate(2-) [Term] id: CHEBI:77285 name: dTDP-beta-L-evernosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:77286 name: 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17810 ! 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77287 name: 1-(Z)-alk-1-enyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17832 ! 1-O-(alk-1-enyl)-sn-glycero-3-phosphocholine is_a: CHEBI:193594 ! 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid is_a: CHEBI:78195 ! 1-(alk-1-enyl)glycero-3-phosphocholine [Term] id: CHEBI:77288 name: 1-(Z)-alk-1-enyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:193594 ! 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid is_a: CHEBI:57514 ! 1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77290 name: 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:167497 ! 1-O-(alk-1-enyl)-2-acyl-sn-glycerolipid is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77291 name: 1-(Z)-alk-1-enyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:75147 ! 1-(alk-1-enyl)-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77292 name: 1-(1Z)-hexadecenyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17810 ! 1-O-(alk-1-enyl)-2-O-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77293 name: (E)-2,3-didehydropristanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:77294 name: 1-(Z)-alk-1-enyl-2-oleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:75148 ! 1-(alk-1-enyl)-2-oleoyl-sn-glycero-3-phosphocholine is_a: CHEBI:77286 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77295 name: 1-(Z)-alk-1-enyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:75155 ! 1-(alk-1-enyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77296 name: 1-(Z)-alk-1-enyl-2-acyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:167497 ! 1-O-(alk-1-enyl)-2-acyl-sn-glycerolipid is_a: CHEBI:73320 ! 1-(alk-1-enyl)-2-acyl-sn-glycerol is_a: CHEBI:77999 ! 1(3)-O-(alk-1-enyl)-2-acylglycerol [Term] id: CHEBI:77297 name: 1-(Z)-alk-1-enyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:193594 ! 1-(Z)-alk-1-enyl-2-lyso-sn-glycerolipid is_a: CHEBI:73322 ! 1-(alk-1-enyl)-sn-glycerol [Term] id: CHEBI:77301 name: 1-(Z)-alk-1-enyl-2-octanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:75255 ! 1-O-(alk-1-enyl)-2-octanoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77302 name: 1-(Z)-alk-1-enyl-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:75256 ! 1-O-(alk-1-enyl)-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77303 name: 1-(Z)-alk-1-enyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:75257 ! 1-O-(alk-1-enyl)-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77304 name: 1-(Z)-alk-1-enyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:75289 ! 1-O-(alk-1-enyl)-2-palmitoyl-sn-glycero-3-phosphocholine is_a: CHEBI:77286 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77305 name: 1-(Z)-alk-1-enyl-2-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:16903 ! 1-O-(alk-1-enyl)-2-O-acylglycerol [Term] id: CHEBI:77307 name: cardioprotective agent is_a: CHEBI:50267 ! protective agent [Term] id: CHEBI:77310 name: (E)-2-methylpentadec-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77318 name: pregnane X receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:77326 name: androstane receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:77330 name: polyunsaturated fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77632 ! unsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:77331 name: monounsaturated fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77632 ! unsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:77332 name: saturated fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:77342 name: 2-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:65214 ! 2-acyl-sn-glycero-3-phosphoserine(1-) [Term] id: CHEBI:77343 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:65090 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:90431 ! phosphatidylinositol(18:0/18:2) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:77344 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate [Term] id: CHEBI:77345 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate [Term] id: CHEBI:77346 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:65090 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol [Term] id: CHEBI:77347 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate [Term] id: CHEBI:77348 name: 1,2-dilinoleoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:77349 name: 1,2-dilinoleoyl-sn-glycero-3-phospho-1D-myo-inositol 5-phosphate is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate [Term] id: CHEBI:7735 name: olanzapine is_a: CHEBI:22720 ! benzodiazepine is_a: CHEBI:46848 ! N-arylpiperazine is_a: CHEBI:46920 ! N-methylpiperazine relationship: has_role CHEBI:37956 ! histamine antagonist relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:48876 ! muscarinic antagonist relationship: has_role CHEBI:50919 ! antiemetic relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor relationship: has_role CHEBI:65191 ! second generation antipsychotic [Term] id: CHEBI:77350 name: neopikromycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:77351 name: novapikromycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77352 name: methymycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77353 name: neomethymycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77354 name: novamethymycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77355 name: 1-palmityl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate relationship: has_part CHEBI:25842 ! palmityl group [Term] id: CHEBI:77357 name: 1-palmityl-2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate relationship: has_part CHEBI:25842 ! palmityl group [Term] id: CHEBI:77358 name: CDP-dipalmitoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol relationship: has_role CHEBI:131604 ! Mycoplasma genitalium metabolite [Term] id: CHEBI:77360 name: (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78862 ! tetracosapentaenoic acid [Term] id: CHEBI:77366 name: (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosahexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:72714 ! tetracosahexaenoic acid [Term] id: CHEBI:77368 name: (11Z,14Z,17Z,20Z,23Z)-hexacosapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78863 ! hexacosapentaenoic acid [Term] id: CHEBI:77369 name: 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77370 name: 1-palmitoyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77371 name: (8Z,11Z,14Z,17Z,20Z,23Z)-hexacosahexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78866 ! hexacosahexaenoic acid [Term] id: CHEBI:77372 name: (13Z,16Z,19Z,22Z,25Z)-octacosapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78869 ! octacosapentaenoic acid [Term] id: CHEBI:77377 name: (12Z,15Z,18Z,21Z,24Z,27Z)-triacontahexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78917 ! triacontahexaenoic acid [Term] id: CHEBI:77379 name: (17Z,20Z,23Z,26Z,29Z)-dotriacontapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78920 ! dotriacontapentaenoic acid [Term] id: CHEBI:77386 name: tricaproin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:87656 ! hexanoate ester relationship: has_role CHEBI:71692 ! insect repellent [Term] id: CHEBI:77387 name: 2,3-dihexanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:87656 ! hexanoate ester [Term] id: CHEBI:77388 name: tricaprin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:77389 name: trilaurin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77390 name: 2,3-didodecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:142953 ! didodecanoylglycerol is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:77391 name: trimyristin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:77392 name: 2,3-dimyristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:77393 name: tripalmitin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:77394 name: 2,3-dipalmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:77395 name: 2,3-distearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:75524 ! 2,3-diacyl-sn-glycerol [Term] id: CHEBI:77396 name: long-chain primary fatty alcohol subset: chebi_ph7_3 is_a: CHEBI:138088 ! long chain primary alcohol is_a: CHEBI:142622 ! primary fatty alcohol is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:77398 name: 2-amino-2-phenylacetonitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:77399 name: D-alpha-phenylglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:77400 name: 2-aminopentanenitrile subset: chebi_ph7_3 is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:80291 ! aliphatic nitrile [Term] id: CHEBI:77403 name: (14Z,17Z,20Z,23Z,26Z,29Z)-dotriacontahexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78919 ! dotriacontahexaenoic acid [Term] id: CHEBI:77404 name: (19Z,22Z,25Z,28Z,31Z)-tetratriacontapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78932 ! tetratriacontapentaenoic acid [Term] id: CHEBI:77409 name: (3S)-3-hydroxy-L-lysine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:77410 name: (4R)-4-hydroxy-L-lysine(1+) subset: chebi_ph7_3 is_a: CHEBI:141496 ! 4-hydroxy-L-lysine(1+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:77411 name: (3S)-3-hydroxy-L-ornithine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:77417 name: tetradecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:195550 ! tetradecanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77425 name: EC 1.1.1.188 (prostaglandin-F synthase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:77427 name: (3R)-3-carboxy-3-hydroxypropanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:136881 ! 3-carboxy-3-hydroxypropanoyl-CoA(5-) [Term] id: CHEBI:77429 name: 1-palmitylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77444 name: 1-undecene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77450 name: dicarboxylic acid monoamide(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:77452 name: 2-deoxystreptamine cation subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:77456 name: 2-iminopropanoate is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:77460 name: L-aminoacyl-L-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:77465 name: 1-oleylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77466 name: 1-dodecylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77467 name: 1-tetradecylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77468 name: pentadecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:195629 ! pentadecanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol [Term] id: CHEBI:77469 name: 1-pentadecylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:7747 name: oleuropein subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26407 ! pyrans is_a: CHEBI:33566 ! catechols is_a: CHEBI:50274 ! secoiridoid glycoside is_a: CHEBI:51307 ! diester relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35674 ! antihypertensive agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:73240 ! NF-kappaB inhibitor relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77470 name: heptadecan-1-ol subset: chebi_ph7_3 is_a: CHEBI:197399 ! heptadecanol is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:77471 name: 1-heptadecylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77472 name: 1-octadecylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77473 name: 1-(9Z,12Z)-octadecadienylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77474 name: (9Z,12Z,15Z)-octadecatrien-1-ol subset: chebi_ph7_3 is_a: CHEBI:77396 ! long-chain primary fatty alcohol relationship: has_role CHEBI:33282 ! antibacterial agent [Term] id: CHEBI:77475 name: 1-(9Z,12Z,15Z)-octadecatrienylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73315 ! 1-alkylglycerone 3-phosphate(2-) [Term] id: CHEBI:77482 name: (3S)-3-hydroxy-L-lysine is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:77483 name: (4R)-4-hydroxy-L-lysine is_a: CHEBI:20391 ! 4-hydroxy-L-lysine [Term] id: CHEBI:77484 name: EC 1.1.1.25 (shikimate dehydrogenase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:77488 name: (3S)-3-hydroxy-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:77492 name: 1-oleoylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57534 ! 1-acylglycerone 3-phosphate(2-) [Term] id: CHEBI:77493 name: 1-linoleoylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57534 ! 1-acylglycerone 3-phosphate(2-) [Term] id: CHEBI:77494 name: 1-arachidonoylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57534 ! 1-acylglycerone 3-phosphate(2-) [Term] id: CHEBI:77497 name: (16Z,19Z,22Z,25Z,28Z,31Z)-tetratriacontahexaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78933 ! tetratriacontahexaenoic acid [Term] id: CHEBI:77499 name: (21Z,24Z,27Z,30Z,33Z)-hexatriacontapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78936 ! hexatriacontapentaenoic acid [Term] id: CHEBI:77500 name: (18Z,21Z,24Z,27Z,30Z,33Z)-hexatriacontahexaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78937 ! hexatriacontahexaenoic acid [Term] id: CHEBI:77503 name: (23Z,26Z,29Z,32Z,35Z)-octatriacontapentaenoic acid is_a: CHEBI:25681 ! omega-3 fatty acid is_a: CHEBI:78939 ! octatriacontapentaenoic acid [Term] id: CHEBI:77506 name: 1-pentadecene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:77521 name: thermal degradation product is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:77522 name: (9Z,12Z)-hexadecadienoic acid is_a: CHEBI:77524 ! hexadecadienoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77523 name: Maillard reaction product is_a: CHEBI:77521 ! thermal degradation product [Term] id: CHEBI:77524 name: hexadecadienoic acid is_a: CHEBI:132494 ! fatty acid 16:2 is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:77525 name: (17Z)-hexacosenoic acid is_a: CHEBI:78865 ! hexacosenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77526 name: (9Z,12Z,15Z,18Z)-tetracosatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78867 ! tetracosatetraenoic acid [Term] id: CHEBI:77527 name: (6Z,9Z,12Z,15Z,18Z)-tetracosapentaenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78862 ! tetracosapentaenoic acid [Term] id: CHEBI:77528 name: (11Z,14Z,17Z,20Z)-hexacosatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78864 ! hexacosatetraenoic acid [Term] id: CHEBI:77532 name: (13Z,16Z,19Z,22Z)-octacosatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78868 ! octacosatetraenoic acid [Term] id: CHEBI:77534 name: (15Z,18Z,21Z,24Z)-triacontatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78915 ! triacontatetraenoic acid [Term] id: CHEBI:77535 name: (17Z,20Z,23Z,26Z)-dotriacontatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78918 ! dotriacontatetraenoic acid [Term] id: CHEBI:77536 name: (19Z,22Z,25Z,28Z)-tetratriacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:36009 ! omega-6 fatty acid [Term] id: CHEBI:77537 name: trans-9-octadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139567 ! octadecenoyl-CoA(4-) [Term] id: CHEBI:77538 name: (21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78935 ! hexatriacontatetraenoic acid [Term] id: CHEBI:77539 name: (23Z,26Z,29Z,32Z)-octatriacontatetraenoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:78938 ! octatriacontatetraenoic acid [Term] id: CHEBI:7754 name: oligonucleotide is_a: CHEBI:61120 ! nucleobase-containing molecular entity [Term] id: CHEBI:77545 name: trans-2-pentadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77547 name: undecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77548 name: trans-2-undecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77549 name: (2E,9Z)-hexadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77550 name: (2R)-pristanoyl-CoA is_a: CHEBI:51341 ! pristanoyl-CoA [Term] id: CHEBI:77551 name: trans-2-heptadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:77552 name: (2E,9E)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:77553 name: (2E,9Z)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:77557 name: (2S)-2-methylpentadecanoyl-CoA is_a: CHEBI:15451 ! (2S)-2-methylacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:77558 name: (2E,9Z,12Z)-octadecatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139563 ! octadecatrienoyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:77559 name: (2E,4Z,7Z,10Z,13Z,16Z,19Z)-docosaheptaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:77560 name: 1,1'-dioleyl 2,2'-dilysocardiolipin is_a: CHEBI:60431 ! 2,2'-dilysocardiolipin [Term] id: CHEBI:77561 name: trioleoyl 2-monolysocardiolipin is_a: CHEBI:60430 ! 2-monolysocardiolipin [Term] id: CHEBI:77575 name: alkyl,acyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76530 ! sn-glycero-3-monophosphate(2-) [Term] id: CHEBI:77576 name: monoalkyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76530 ! sn-glycero-3-monophosphate(2-) is_a: CHEBI:78169 ! monoalkylglycerophosphate(2-) [Term] id: CHEBI:77578 name: monoalkyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion is_a: CHEBI:78204 ! monoalkylglycerophosphoethanolamine zwitterion [Term] id: CHEBI:77580 name: 1-hexadecyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58014 ! 1-alkyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:77583 name: (2S)-2-acetamido-4-aminobutanoic acid is_a: CHEBI:21545 ! N-acetyl-L-amino acid [Term] id: CHEBI:77587 name: (2S)-2-acetamido-4-aminobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:77589 name: monoacyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76530 ! sn-glycero-3-monophosphate(2-) [Term] id: CHEBI:77592 name: monacyl-sn-glycero-3-phospho-(1'-sn-glycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:78210 ! monoacylglycero-3-phosphoglycerol(1-) [Term] id: CHEBI:77593 name: 2-oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64982 ! 2-acyl-sn-glycero-3-phosphate(2-) is_a: CHEBI:84973 ! oleoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:776 name: 16alpha-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:77609 name: monoalk-1-enyl-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:76530 ! sn-glycero-3-monophosphate(2-) [Term] id: CHEBI:77611 name: monoalk-1-enyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:77578 ! monoalkyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:77612 name: cis,cis-2-ammonio-3-(3-oxoprop-1-enyl)but-2-enedioate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35693 ! dicarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77617 name: senecionine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77618 name: norajmaline(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77619 name: 1,3-dipalmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:142940 ! dihexadecanoylglycerol is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:77620 name: 5-oxido-6-methylpyridinium-3,4-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:36173 ! pyridinedicarboxylate [Term] id: CHEBI:77621 name: 2',3,4,4',6'-pentahydroxychalcone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77622 name: 2',3,4,4',6'-pentahydroxychalcone 4'-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77623 name: 1-palmitoyl-2-oleoyl-3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol [Term] id: CHEBI:77624 name: 1-palmitoyl-3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:47777 ! 1,3-diglyceride [Term] id: CHEBI:77630 name: trans-2-pentadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:77631 name: 1-piperideine-2-carboxylic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77632 name: unsaturated fatty acyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:77633 name: isonocardicin A(2-) subset: chebi_ph7_3 is_a: CHEBI:142513 ! oxime anion is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:77634 name: 2-aminomuconic 6-semialdehyde zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:77636 name: fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:77638 name: dihydrophloroglucinol(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77639 name: sulochrin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77640 name: apiin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77641 name: anthocyanidin 3,5-diglucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77642 name: 2'-O-methyllicodione(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77643 name: protoaphin aglucone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77644 name: 5-L-glutamyl amino acid(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:77645 name: 2',4,4',6'-tetrahydroxychalcone(1-) subset: chebi_ph7_3 is_a: CHEBI:134371 ! 2-acyl-4-prenylphloroglucinol(1-) is_a: CHEBI:15413 ! 2',4,4',6'-tetrahydroxychalcone is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:50857 ! anti-allergic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:77646 name: 2-oleoyl-sn-glycero-3-phosphoserine is_a: CHEBI:37646 ! 2-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:77647 name: 2,3',4,6-tetrahydroxybenzophenone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77648 name: novapikromycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:77652 name: novamethymycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:77653 name: (3R)-3-carboxy-3-hydroxypropanoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA [Term] id: CHEBI:77654 name: EC 1.1.1.267 (1-deoxy-D-xylulose-5-phosphate reductoisomerase) inhibitor is_a: CHEBI:76835 ! EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor [Term] id: CHEBI:77656 name: 4-oxoproline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:77657 name: 5-amino-1-(5-phosphonato-D-ribosyl)imidazolium-4-carboxylate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:77658 name: nocardicin A(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:77659 name: emodin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:38637 ! tyrosine kinase inhibitor relationship: has_role CHEBI:50503 ! laxative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77660 name: pyrroloquinoline quinol(4-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:77662 name: L-3-oxoalanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:77663 name: pulcherriminate(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77667 name: 2,4-divinyl protochlorophyllide a(1-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:77670 name: primary fluorescent chlorophyll catabolite(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:77671 name: luteolin 7-O-beta-D-glucosiduronate(2-) subset: chebi_ph7_3 is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:77672 name: N-acyl-D-phenylalanine is_a: CHEBI:15778 ! N-acyl-D-amino acid [Term] id: CHEBI:77673 name: N-acyl-L-phenylalanine is_a: CHEBI:21644 ! N-acyl-L-amino acid is_a: CHEBI:84144 ! L-phenylalanine derivative [Term] id: CHEBI:77674 name: queuine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77676 name: 1-palmityl-2-acetyl-3-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol [Term] id: CHEBI:77677 name: 1-palmityl-2-acetyl-3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol [Term] id: CHEBI:77678 name: 1-palmityl-2-acetyl-3-myristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:77679 name: 1-hexadecyl-2-acetyl-3-decanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:77680 name: 1-palmityl-2-acetyl-3-palmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol [Term] id: CHEBI:77681 name: 1-palmityl-2-acetyl-3-lauroyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77682 name: 1-palmityl-2-acetyl-3-capryloyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17473 ! 1-alkyl-2-acetyl-3-acyl-sn-glycerol is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:77683 name: 1,2-dioleoyl-3-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:144774 ! linoleoyl containing 1,2,3-triacyl-sn-glycerol is_a: CHEBI:64615 ! triacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:77684 name: 1,2-dioleoyl-3-myristoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:77685 name: 1,2-dioleoyl-3-lauroyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:77686 name: 1,2-dioleoyl-3-stearoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol [Term] id: CHEBI:77687 name: 2'-hydroxyformononetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77688 name: formononetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77689 name: L-mimosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:77694 name: 1-arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:140161 ! phosphatidylcholine (20:4/16:0) is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77695 name: 1-arachidonyl-2-palmityl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:15843 ! arachidonic acid is_a: CHEBI:65215 ! 1-acyl-2-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77696 name: 2-hexadecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:72805 ! 2-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77699 name: methyl formate subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:52343 ! formate ester relationship: has_role CHEBI:24852 ! insecticide relationship: has_role CHEBI:39276 ! fumigant relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:78433 ! refrigerant [Term] id: CHEBI:77700 name: methyl acetate subset: chebi_ph7_3 is_a: CHEBI:134179 ! volatile organic compound is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:48358 ! polar aprotic solvent relationship: has_role CHEBI:77706 ! EC 3.4.19.3 (pyroglutamyl-peptidase I) inhibitor [Term] id: CHEBI:77703 name: EC 4.3.1.3 (histidine ammonia-lyase) inhibitor is_a: CHEBI:76832 ! EC 4.3.1.* (ammonia-lyase) inhibitor [Term] id: CHEBI:77705 name: EC 3.4.19.* (omega-peptidase) inhibitor is_a: CHEBI:60258 ! EC 3.4.* (hydrolases acting on peptide bond) inhibitor [Term] id: CHEBI:77706 name: EC 3.4.19.3 (pyroglutamyl-peptidase I) inhibitor is_a: CHEBI:77705 ! EC 3.4.19.* (omega-peptidase) inhibitor [Term] id: CHEBI:77709 name: alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')--N-acylsphingosine(1-) subset: chebi_ph7_3 is_a: CHEBI:82639 ! alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) [Term] id: CHEBI:77710 name: 3',4',5-trihydroxy-3,7-dimethoxyflavone(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77711 name: licodione(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77712 name: xanthoaphin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77715 name: nasal decongestant is_a: CHEBI:23888 ! drug [Term] id: CHEBI:77717 name: 2,2'-lysobisphosphatidate subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:77718 name: carboxamidinium ion is_a: CHEBI:35286 ! iminium ion [Term] id: CHEBI:77720 name: 1,1'-lysobisphosphatidate subset: chebi_ph7_3 is_a: CHEBI:83236 ! 2-acylglycerophospho-(2'-acylglycerol)(1-) [Term] id: CHEBI:77722 name: apigenin 7-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35475 ! non-steroidal anti-inflammatory drug [Term] id: CHEBI:77724 name: 1-decanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:77725 name: 17-O-acetylnorajmaline(1+) subset: chebi_ph7_3 is_a: CHEBI:60521 ! indole alkaloid cation [Term] id: CHEBI:77726 name: 1-decanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:77727 name: delta-lactam is_a: CHEBI:24995 ! lactam [Term] id: CHEBI:77728 name: bergaptol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77740 name: adenosine 2'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:78552 ! ribonucleoside 2'-monophosphate(2-) [Term] id: CHEBI:77746 name: human metabolite is_a: CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:77748 name: EC 3.6.3.44 (xenobiotic-transporting ATPase) inhibitor is_a: CHEBI:76895 ! EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor [Term] id: CHEBI:77749 name: 1-palmitoyl-2-(10-hydroperoxy-8E-octadecenoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:7775 name: ononin subset: chebi_ph7_3 is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:140301 ! 7-hydroxyisoflavones 7-O-beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77753 name: 1-palmitoyl-2-[(10E)-9-hydroperoxyoctadecenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:167115 ! oxidized glycerophosphocholine zwitterion is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77754 name: 9-hydroperoxy-10E-octadecenoate subset: chebi_ph7_3 is_a: CHEBI:133557 ! hydroperoxyoctadecenoate [Term] id: CHEBI:77755 name: 10-hydroperoxy-8E-octadecenoate subset: chebi_ph7_3 is_a: CHEBI:133557 ! hydroperoxyoctadecenoate is_a: CHEBI:64012 ! hydroperoxy fatty acid anion [Term] id: CHEBI:77756 name: 2-O-glutaroyl-1-O-palmitoyl-sn-glycero-3-phosphocholine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:77764 name: daidzein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:131699 ! EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76989 ! phytoestrogen [Term] id: CHEBI:77765 name: 2,4,6-trihydroxybenzophenone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77766 name: cytidine 2'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:78552 ! ribonucleoside 2'-monophosphate(2-) [Term] id: CHEBI:77767 name: 3,6-dichlorocatechol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77769 name: 3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77770 name: 3',5-dihydroxy-3,4',7-trimethoxyflavone(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77771 name: cyanidin 3-O-(6-O-glucosyl-2-O-xylosylgalactoside) betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77772 name: ilicicolin H subset: chebi_ph7_3 is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:146212 ! ilicicolin is_a: CHEBI:33853 ! phenols is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:38182 ! monohydroxypyridine is_a: CHEBI:38183 ! pyridone is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:25355 ! mitochondrial respiratory-chain inhibitor relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:77786 name: 1-hexadecyl-2-ammonio-2-deoxy-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:77787 name: 1-O-palmityl-2-desoxy-2-amino-sn-glycero-3-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:77791 name: luteolin 7-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77798 name: melamine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:76206 ! xenobiotic metabolite [Term] id: CHEBI:77800 name: 2'-hydroxydaidzein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:77802 name: uridine 2'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:78552 ! ribonucleoside 2'-monophosphate(2-) [Term] id: CHEBI:77803 name: 2-ammonio-3-(3-oxoprop-1-enyl)but-2-enedioate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:77804 name: biochanin A 7-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77805 name: enterobactin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:26672 ! siderophore relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:77810 name: 2-16:1-lysophosphatidate(2-) subset: chebi_ph7_3 is_a: CHEBI:64982 ! 2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:77811 name: 1-acyl-2-hexadecenoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:77812 name: 9-oxononanoate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:71944 ! aldehydic acid anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion relationship: has_role CHEBI:70722 ! EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor [Term] id: CHEBI:7782 name: oripavine is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:25698 ! ether is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:38164 ! organic heteropentacyclic compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:35482 ! opioid analgesic relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:77824 name: cyanidin 3-O-(2-O-beta-D-glucuronosyl)-beta-D-glucoside(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77825 name: luteolin 7-O-[(beta-D-glucosyluronate)-(1->2)-(beta-D-glucosiduronate)] 4'-O-beta-D-glucosiduronate(4-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:77826 name: mugineate(1-) subset: chebi_ph7_3 is_a: CHEBI:35753 ! tricarboxylic acid anion [Term] id: CHEBI:77827 name: 2-arylethylammomium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:77828 name: guanosine 3',5'-bis(diphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:77830 name: 2-arachidonoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:65214 ! 2-acyl-sn-glycero-3-phosphoserine(1-) [Term] id: CHEBI:77831 name: 1-palmitoyl-2-propionyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77832 name: 1-palmitoyl-2-butanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77833 name: 1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:77836 name: N-[omega-(acylyloxy)]acylsphin-4-enine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:77838 name: delphinidin 3-O-beta-D-glucoside-5-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77840 name: 3,8'-biflaviolin 2,7,2'-triolate subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77842 name: stipitatate(1-) subset: chebi_ph7_3 is_a: CHEBI:35975 ! 5-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:77843 name: thymidine 3'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:131705 ! 2'-deoxynucleoside 3'-monophosphate(2-) [Term] id: CHEBI:77844 name: delphinidin 3,3',5-tri-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77846 name: dehydroglycine zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77847 name: glycerol 1-phosphodiester(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:77848 name: 3-(3,4-dihydroxypyridinium-1-yl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:76042 ! aromatic amino-acid zwitterion [Term] id: CHEBI:77851 name: (2S)-2-ammonio-3-oxo-4-(phosphonatooxy)butanoate(2-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:77852 name: 9(S)-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:131861 ! HODE(1-) is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:77853 name: persistent organic pollutant is_a: CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:77857 name: cyanidin 3-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:16307 ! anthocyanidin 3-O-beta-D-glucoside is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77858 name: 4-hydroxycoumarin(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77859 name: (2Z,4E)-2-ammoniomuconate(1-) subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion is_a: CHEBI:35695 ! dicarboxylic acid monoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:77860 name: 3-cyano-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:77862 name: gossypetin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77869 name: (E,E)-sorbate subset: chebi_ph7_3 is_a: CHEBI:36550 ! sorbate [Term] id: CHEBI:77870 name: precorrin-3B(6-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:77871 name: precorrin-5(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:77872 name: precorrin-6A(7-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:77873 name: hydrogenobyrinate(4-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:77874 name: hydrogenobyrinic acid a,c-diamide(2-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion [Term] id: CHEBI:77875 name: iminoaspartate(1-) subset: chebi_ph7_3 is_a: CHEBI:35695 ! dicarboxylic acid monoanion [Term] id: CHEBI:77876 name: biochanin A 7-O-beta-D-glucoside 6''-O-malonate(2-) subset: chebi_ph7_3 is_a: CHEBI:35973 ! 3-oxo monocarboxylic acid anion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77877 name: 3,3'-biflaviolin(3-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77881 name: EC 4.3.1.15 (diaminopropionate ammonia-lyase) inhibitor is_a: CHEBI:76832 ! EC 4.3.1.* (ammonia-lyase) inhibitor [Term] id: CHEBI:77885 name: nocardicin E(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:77886 name: demethylsulochrin(2-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77887 name: delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside(2-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77888 name: N-[omega-(linoleoyloxy)]acylsphin-4-enine subset: chebi_ph7_3 is_a: CHEBI:77836 ! N-[omega-(acylyloxy)]acylsphin-4-enine [Term] id: CHEBI:77889 name: N-[omega-(9R)-hydroperoxy(10E,12Z)-octadecadienoyloxy]acylsphin-4-enine subset: chebi_ph7_3 is_a: CHEBI:77836 ! N-[omega-(acylyloxy)]acylsphin-4-enine [Term] id: CHEBI:77890 name: 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:77891 name: N-[omega-(9R,10R)-epoxy-(13R)-hydroxy-(11E)-octadecenoyloxy]sphing-4-enine subset: chebi_ph7_3 is_a: CHEBI:77836 ! N-[omega-(acylyloxy)]acylsphin-4-enine [Term] id: CHEBI:77893 name: 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:77894 name: aci-nitroethane subset: chebi_ph7_3 is_a: CHEBI:136622 ! aci-nitro compound [Term] id: CHEBI:77895 name: 9(R)-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131860 ! octadecanoid anion is_a: CHEBI:131861 ! HODE(1-) is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:77896 name: 8-oxo-dGTP(4-) subset: chebi_ph7_3 is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:77897 name: 2-hydroxy-dATP(4-) subset: chebi_ph7_3 is_a: CHEBI:61662 ! 2'-deoxyribonucleoside triphosphate oxoanion [Term] id: CHEBI:77899 name: (S)-averantin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:77900 name: (1'S,5'S)-5'-hydroxyaverantin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77901 name: anthocyanidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] 5-O-beta-D-glucoside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77904 name: norsolorinic acid anthrone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77906 name: minocycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:144644 ! a tetracycline zwitterion is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77907 name: hydroxyversicolorone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77913 name: 9(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:146289 ! 9-HPETE(1-) is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:77914 name: 3-methylbut-1-ene subset: chebi_ph7_3 is_a: CHEBI:32878 ! alkene [Term] id: CHEBI:77919 name: (7R)-hydroxy-(5S,6S)-epoxy-(8Z,11Z,14Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:77922 name: isopentenol subset: chebi_ph7_3 is_a: CHEBI:33823 ! enol [Term] id: CHEBI:77927 name: nonan-2-one subset: chebi_ph7_3 is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77931 name: cyanidin 3-O-\{6-O-[6-O-(4-coumaroyl)-beta-D-glucosyl]-2-O-beta-D-xylosyl-beta-D-galactoside}(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77932 name: tetracycline zwitterion subset: chebi_ph7_3 is_a: CHEBI:144644 ! a tetracycline zwitterion is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:48001 ! protein synthesis inhibitor [Term] id: CHEBI:77933 name: (S)-5'-oxoaverantin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77935 name: cyanidin 3-O-beta-D-galactoside(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:78295 ! food component [Term] id: CHEBI:77938 name: barbiturate(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:77939 name: oroxylin A(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor [Term] id: CHEBI:7794 name: phosphate monoester is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37734 ! phosphoric ester [Term] id: CHEBI:77941 name: EC 3.5.1.4 (amidase) inhibitor is_a: CHEBI:76807 ! EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor [Term] id: CHEBI:77943 name: anthocyanidin 3-glucoside 5-[(6-O-4-hydroxycinnamoyl)glucoside] betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77944 name: anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77945 name: anthocyanidin 3-O-beta-D-sambubioside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77946 name: anthocyanidin 3-O-sophoroside betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:77947 name: (S)-versiconol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77948 name: isoliquiritigenin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77950 name: (2S-3S)-versiconal hemiacetal(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77951 name: versicolorin B(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77953 name: EC 6.1.1.4 (leucine--tRNA ligase) inhibitor is_a: CHEBI:75416 ! EC 6.1.1.* (ligases forming aminoacyl tRNA and related compounds) inhibitor [Term] id: CHEBI:77956 name: L-erythro-sphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:77961 name: 1,2-dioctanoyl-sn-glycerol 3-diphosphate is_a: CHEBI:59998 ! 1,2-diacyl-sn-glycerol 3-diphosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:77962 name: food antioxidant is_a: CHEBI:22586 ! antioxidant is_a: CHEBI:65255 ! food preservative [Term] id: CHEBI:77964 name: anticaking agent is_a: CHEBI:33232 ! application [Term] id: CHEBI:77965 name: food anticaking agent is_a: CHEBI:64047 ! food additive is_a: CHEBI:77964 ! anticaking agent [Term] id: CHEBI:77966 name: food stabiliser is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:77968 name: humectant is_a: CHEBI:33232 ! application [Term] id: CHEBI:77969 name: food humectant is_a: CHEBI:64047 ! food additive is_a: CHEBI:77968 ! humectant [Term] id: CHEBI:77970 name: food thickening agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:77971 name: raising agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:77974 name: food packaging gas is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:77975 name: (2S,3S)-versiconal hemiacetal acetate(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77976 name: versicolorin A(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77977 name: noreugenin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:77978 name: 2',4,4',6'-tetrahydroxychalcone 4'-O-beta-D-glucoside(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77979 name: aclacinomycin T zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:77980 name: aclacinomycin A zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50750 ! EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:77981 name: vancomycin aglycone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:77982 name: tetracenomycin F2(2-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77983 name: 1,5-bis(diphospho)-1D-myo-inositol 2,3,4,6-tetrakisphosphate(13-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:77984 name: quercetin 3,3',7-trissulfate(4-) subset: chebi_ph7_3 is_a: CHEBI:139371 ! aryl sulfate oxoanion is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:77985 name: aclacinomycin Y zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:77987 name: aklanonate(2-) subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77988 name: methyl aklanonate(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77989 name: luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)](3-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:77990 name: tetracenomycin D3(2-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77991 name: aclacinomycin N zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:77992 name: calycosin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:77994 name: aklaviketone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:77996 name: N-oleoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:77997 name: 1(3)-O-alkylglycerol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol is_a: CHEBI:76575 ! monoradylglycerol [Term] id: CHEBI:77998 name: 1(3)-O-(alk-1-enyl)-glycerol subset: chebi_ph7_3 is_a: CHEBI:24353 ! glycerol ether is_a: CHEBI:35741 ! glycerolipid is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:76575 ! monoradylglycerol [Term] id: CHEBI:77999 name: 1(3)-O-(alk-1-enyl)-2-acylglycerol subset: chebi_ph7_3 is_a: CHEBI:76583 ! alk-1-enylacylglycerol [Term] id: CHEBI:78001 name: N-dodecanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:78003 name: food bleaching agent is_a: CHEBI:132717 ! bleaching agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:78004 name: food bulking agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:78013 name: linoleic acid hydroperoxide is_a: CHEBI:36329 ! HPODE [Term] id: CHEBI:78016 name: food gelling agent is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:78017 name: food propellant is_a: CHEBI:64047 ! food additive is_a: CHEBI:76414 ! propellant [Term] id: CHEBI:78022 name: 1-stearoyl-2-(alpha-linolenoyl)-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78033 name: methyl arachidonate subset: chebi_ph7_3 is_a: CHEBI:4986 ! fatty acid methyl ester relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:78034 name: 12(R)-HPETE methyl ester subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:4986 ! fatty acid methyl ester [Term] id: CHEBI:78035 name: 12(S)-HPETE methyl ester subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:4986 ! fatty acid methyl ester [Term] id: CHEBI:78040 name: 13(S)-HPODE methyl ester subset: chebi_ph7_3 is_a: CHEBI:4986 ! fatty acid methyl ester [Term] id: CHEBI:78043 name: (5Z,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78044 name: 1-oleoyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:78421 ! 1-oleoyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78045 name: 2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:16728 ! 2-acyl-sn-glycero-3-phosphocholine(1+) [Term] id: CHEBI:78046 name: 12(S)-HPE(5,8,10)TrE(1-) subset: chebi_ph7_3 is_a: CHEBI:131875 ! hydroperoxyicosatrienoate [Term] id: CHEBI:78047 name: 12(S)-HPE(8,10,14)TrE(1-) subset: chebi_ph7_3 is_a: CHEBI:83334 ! 12-HPE(8,10,14)TrE(1-) [Term] id: CHEBI:78048 name: 14(S)-HPDHE(1-) subset: chebi_ph7_3 is_a: CHEBI:83336 ! 14-HPDHE(1-) [Term] id: CHEBI:78049 name: octadecenoate subset: chebi_ph7_3 is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78050 name: octadecatetraenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78051 name: hexacosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78052 name: tetracosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78053 name: docosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78054 name: hexacosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78055 name: hexacosenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78056 name: tetracosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78057 name: hexacosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78059 name: food additive carrier is_a: CHEBI:64047 ! food additive [Term] id: CHEBI:78060 name: docosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78061 name: tetracosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78062 name: octacosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78063 name: octacosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78068 name: tetracosenoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78069 name: docosatetraenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78070 name: 10(R)-HPO(6,8,12)TrE(1-) subset: chebi_ph7_3 is_a: CHEBI:83342 ! 10-HPO(6,8,12)TrE(1-) [Term] id: CHEBI:78072 name: icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78073 name: icosadienoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78075 name: icosenoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78076 name: docosenoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78078 name: 12-HPEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131876 ! hydroperoxyicosapentaenoate relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor [Term] id: CHEBI:78079 name: triacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78080 name: triacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78081 name: dotriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78082 name: dotriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78083 name: dotriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78084 name: hepoxilin B3(1-) subset: chebi_ph7_3 is_a: CHEBI:62938 ! hepoxilin anion [Term] id: CHEBI:78085 name: N-hexadecanoylphosphatidylethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:78086 name: tetratriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78087 name: tetratriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78088 name: tetratriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78089 name: hexatriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78090 name: 1,2-dipalmitoylglycerol subset: chebi_ph7_3 is_a: CHEBI:142940 ! dihexadecanoylglycerol is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:78091 name: hexatriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78092 name: hexatriacontahexaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78093 name: octatriacontatetraenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78094 name: octatriacontapentaenoate subset: chebi_ph7_3 is_a: CHEBI:143005 ! ultra-long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78095 name: hexadecenoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78096 name: hexadecadienoate subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78097 name: N-palmitoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:78098 name: 1-palmitylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78099 name: trioxilin B3(1-) subset: chebi_ph7_3 is_a: CHEBI:78415 ! trioxilin anion [Term] id: CHEBI:78100 name: trioxilin A3(1-) subset: chebi_ph7_3 is_a: CHEBI:78415 ! trioxilin anion [Term] id: CHEBI:78101 name: 1-tetradecyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36707 ! 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78102 name: 1-tetradecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78103 name: 1-dodecyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36707 ! 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78104 name: 1-dodecyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78108 name: 1-decyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36707 ! 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78109 name: 1-decyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:30909 ! 1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78111 name: 1-oleylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78112 name: 1-dodecylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78113 name: fatty acid anion 3:0 subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78114 name: 1-tetradecylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78115 name: fatty acid anion 4:0 subset: chebi_ph7_3 is_a: CHEBI:58951 ! short-chain fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78116 name: fatty acid anion 6:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion [Term] id: CHEBI:78117 name: fatty acid anion 8:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78118 name: fatty acid anion 10:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78119 name: fatty acid anion 12:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78121 name: fatty acid anion 14:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78122 name: fatty acid anion 15:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78123 name: fatty acid anion 16:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78124 name: fatty acid anion 17:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78125 name: fatty acid anion 18:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78126 name: fatty acid anion 20:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78127 name: fatty acid anion 22:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78128 name: fatty acid anion 24:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78129 name: fatty acid anion 26:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78130 name: fatty acid anion 28:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78131 name: fatty acid anion 30:0 subset: chebi_ph7_3 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78133 name: fatty alcohol 14:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78134 name: fatty alcohol 15:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78135 name: 1-pentadecylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78136 name: fatty alcohol 16:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78137 name: fatty alcohol 17:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78138 name: fatty alcohol 18:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78139 name: fatty alcohol 20:0 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78141 name: 1-heptadecylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78146 name: trans-9-octadecenoyl-CoA is_a: CHEBI:139574 ! octadecenoyl-CoA [Term] id: CHEBI:78147 name: fatty alcohol 18:1 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:7815 name: oxalosuccinic acid is_a: CHEBI:27093 ! tricarboxylic acid relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:78150 name: fatty alcohol 18:2 subset: chebi_ph7_3 is_a: CHEBI:17135 ! long-chain fatty alcohol [Term] id: CHEBI:78163 name: 1-octadecylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78164 name: 1-(9Z,12Z)-octadecadienylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78165 name: 1-(9Z,12Z,15Z)-octadecatrienylglycerone 3-phosphate is_a: CHEBI:17197 ! 1-alkylglycerone 3-phosphate [Term] id: CHEBI:78166 name: 2-lysophosphatidate(2-) subset: chebi_ph7_3 is_a: CHEBI:78172 ! monoacylglycerol 3-phosphate(2-) [Term] id: CHEBI:78167 name: 1-lysophosphatidate(2-) subset: chebi_ph7_3 is_a: CHEBI:78172 ! monoacylglycerol 3-phosphate(2-) [Term] id: CHEBI:78168 name: 1-alkylglycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78169 ! monoalkylglycerophosphate(2-) [Term] id: CHEBI:78169 name: monoalkylglycerophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:78170 name: 1-acylglycerophosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78201 ! monoacylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78171 name: monoalkenylglycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:78172 name: monoacylglycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:78173 name: 1-linoleoylglycerone 3-phosphate is_a: CHEBI:15835 ! 1-acylglycerone 3-phosphate [Term] id: CHEBI:78174 name: 1-(alk-1-enyl)-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78171 ! monoalkenylglycero-3-phosphate(2-) [Term] id: CHEBI:78175 name: 1-arachidonoylglycerone 3-phosphate is_a: CHEBI:15835 ! 1-acylglycerone 3-phosphate [Term] id: CHEBI:78176 name: undecanoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:78177 name: trans-2-undecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:78178 name: (2E,9Z)-hexadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:78179 name: trans-2-heptadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:78181 name: (2E,9E)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:78182 name: 1-alkyl-2-acyl-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78184 ! monoalkylmonoacylglycerolphosphate(2-) [Term] id: CHEBI:78183 name: 1-alkenyl-2-acyl-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:78184 name: monoalkylmonoacylglycerolphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78185 ! glycero-3-monophosphate(2-) [Term] id: CHEBI:78185 name: glycero-3-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78186 name: 1-alkyl-2-acyl-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:78189 ! alkylacylglycero-3-phosphocholine [Term] id: CHEBI:78187 name: (2E,9Z)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:78188 name: 1-(alk-1-enyl)-2-acyl-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:78189 name: alkylacylglycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:78190 name: (2E,9Z,12Z)-octadecatrienoyl-CoA is_a: CHEBI:139576 ! octadecatrienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:78191 name: 2-lysophosphatidylcholine subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:78192 name: 1-lysophosphatidylcholine subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:78193 name: 1-alkylglycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:78196 ! monoalkylglycerophosphocholine [Term] id: CHEBI:78194 name: (2E,4Z,7Z,10Z,13Z,16Z,19Z)-docosaheptaenoyl-coenzyme A is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85555 ! (2E,4Z)-dienoyl-CoA [Term] id: CHEBI:78195 name: 1-(alk-1-enyl)glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine [Term] id: CHEBI:78196 name: monoalkylglycerophosphocholine subset: chebi_ph7_3 is_a: CHEBI:36313 ! glycerophosphocholine is_a: CHEBI:64611 ! ether lipid [Term] id: CHEBI:78197 name: 1-alkyl-2-acyl-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78199 ! alkylacylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78198 name: 1-(alk-1-enyl)-2-acyl-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:78199 name: alkylacylglycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:78200 name: 2-acylglycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78201 ! monoacylglycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78201 name: monoacylglycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:78202 name: 1-alkylglycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78204 ! monoalkylglycerophosphoethanolamine zwitterion [Term] id: CHEBI:78203 name: 1-(alk-1-enyl)-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:78204 name: monoalkylglycerophosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64611 ! ether lipid is_a: CHEBI:72823 ! glycerophosphoethanolamine zwitterion [Term] id: CHEBI:78206 name: fatty acid ethyl ester subset: chebi_ph7_3 is_a: CHEBI:23990 ! ethyl ester is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:78207 name: 1-palmitoyl-2-azelaoyl-sn-glycero-3-phosphocholine(1-) subset: chebi_ph7_3 is_a: CHEBI:167115 ! oxidized glycerophosphocholine zwitterion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78208 name: azelaate(2-) subset: chebi_ph7_3 is_a: CHEBI:132955 ! azelaate is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:78209 name: 2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64982 ! 2-acyl-sn-glycero-3-phosphate(2-) relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:78210 name: monoacylglycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78211 name: 1-acylglycero-3-phospho-1'-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:78210 ! monoacylglycero-3-phosphoglycerol(1-) [Term] id: CHEBI:78213 name: 1-acylglycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:78221 ! monoacylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78214 name: 2-acylglycero-3-phospho-Lserine(1-) subset: chebi_ph7_3 is_a: CHEBI:78221 ! monoacylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78215 name: 1-hexanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:85563 ! lysophosphatidylcholine 6:0 is_a: CHEBI:87656 ! hexanoate ester [Term] id: CHEBI:78216 name: alpha,beta-didehydrotryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78218 name: 1-(alk-1-enyl)-2-acetyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60260 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78220 name: 2-methyl-1-pyrrolinium subset: chebi_ph7_3 is_a: CHEBI:35286 ! iminium ion [Term] id: CHEBI:78221 name: monoacylglycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78222 name: (R)-2-methylpyrrolidinium subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:78223 name: 1-caproyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57970 ! 1-acyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78224 name: 1-alkyl-2-acylglycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:78225 ! alkyl,acylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78225 name: alkyl,acylglycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78226 name: 1,2-dicapryl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:78227 name: 1,2-dicapryl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78228 name: 1,2-dioctanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:78229 name: 1,2-dioctanoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78231 name: 1,2-diacylglycero-3-phospho-1-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78232 name: 1-acylglycero-3-phospho-1-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:78234 ! monoacylglycero-3-phospho-1-inositol(1-) [Term] id: CHEBI:78233 name: 2-acylglycero-3-phospho-1-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:78234 ! monoacylglycero-3-phospho-1-inositol(1-) [Term] id: CHEBI:78234 name: monoacylglycero-3-phospho-1-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78236 name: N-acetyl-L-cysteinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:36044 ! antiviral drug relationship: has_role CHEBI:73336 ! vulnerary relationship: has_role CHEBI:74529 ! antidote to paracetamol poisoning relationship: has_role CHEBI:77034 ! mucolytic relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78237 name: 3-amino-4-hydroxybenzaldehyde subset: chebi_ph7_3 is_a: CHEBI:24673 ! hydroxybenzaldehyde is_a: CHEBI:48975 ! substituted aniline relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78239 name: 3-methyl-L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78241 name: 5-hydroxy-3-methyl-L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78245 name: (2-amino-1-hydroxyethyl)phosphonate zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:78247 name: (4S)-4-hydroxy-L-isoleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78251 name: 5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78252 name: 3-hydroxy-5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78255 name: 3alpha-hydroxy-ent-sandaracopimaradiene subset: chebi_ph7_3 is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78256 name: oryzalexin D subset: chebi_ph7_3 is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78257 name: isogloboside is_a: CHEBI:36520 ! oligoglycosylceramide [Term] id: CHEBI:78259 name: oryzalexin E subset: chebi_ph7_3 is_a: CHEBI:79084 ! tricyclic diterpenoid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78260 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:78261 name: 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71739 ! phosphatidylethanolamine 38:6 zwitterion [Term] id: CHEBI:78262 name: 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72077 ! phosphatidylserine 38:6(1-) [Term] id: CHEBI:78263 name: 1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145182 ! 1-O-(1Z-octadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78264 name: 1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:78355 ! 1-(1Z-alkenyl)-2-acyl-sn-glycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78265 name: 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72084 ! phosphatidylserine 40:6(1-) [Term] id: CHEBI:78266 name: 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71746 ! phosphatidylethanolamine 40:6 zwitterion [Term] id: CHEBI:78267 name: 3-deoxy-D-threo-hex-2-ulosarate(2-) subset: chebi_ph7_3 is_a: CHEBI:24576 ! hexaric acid anion [Term] id: CHEBI:78268 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:189703 ! 1-stearoyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:71737 ! phosphatidylethanolamine 38:4 zwitterion [Term] id: CHEBI:78269 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:72075 ! phosphatidylserine 38:4(1-) [Term] id: CHEBI:78270 name: 2-oleoyl-sn-glycero-3-phosphate is_a: CHEBI:17936 ! 2-acyl-sn-glycero-3-phosphate [Term] id: CHEBI:78272 name: 9-cis-retinol subset: chebi_ph7_3 is_a: CHEBI:50211 ! retinol [Term] id: CHEBI:78273 name: 9-cis-retinal subset: chebi_ph7_3 is_a: CHEBI:15035 ! retinal [Term] id: CHEBI:78274 name: ferruginol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:36762 ! abietane diterpenoid is_a: CHEBI:38032 ! carbotricyclic compound is_a: CHEBI:64419 ! meroterpenoid relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50267 ! protective agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78275 name: N(5)-hydroxy-L-ornithine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78276 name: omega-hydroxyphylloquinone subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26106 ! phylloquinones [Term] id: CHEBI:78277 name: menaquinone-4 subset: chebi_ph7_3 is_a: CHEBI:16374 ! menaquinone relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78278 name: omega-hydroxymenaquinone-4 subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26254 ! prenylnaphthoquinone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78279 name: lysophosphatidate 18:1 subset: chebi_ph7_3 is_a: CHEBI:77589 ! monoacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78281 name: 2,7-dihydroxy-5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78282 name: 2-hydroxy-7-methoxy-5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78283 name: 8-demethyl-8-(alpha-L-rhamnosyl)tetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:33853 ! phenols is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:47985 ! enol ether is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78285 name: 8-demethyl-8-(2-O-methyl-alpha-L-rhamnosyl)tetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78286 name: 8-demethyl-8-(2,3-O-dimethyl-alpha-L-rhamnosyl)tetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether is_a: CHEBI:48132 ! tetracenomycin is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78287 name: 8-demethyl-8-(2,3,4-O-trimethyl-alpha-L-rhamnosyl)tetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:27848 ! alpha-L-rhamnoside is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78290 name: L-m-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:78293 name: ophiobolin F subset: chebi_ph7_3 is_a: CHEBI:26660 ! sesterterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:78294 name: (3R)-3-hydroxy-L-argininium residue subset: chebi_ph7_3 is_a: CHEBI:141997 ! hydroxy-L-argininium residue is_a: CHEBI:58942 ! amino-acid cation residue [Term] id: CHEBI:78295 name: food component is_a: CHEBI:52211 ! physiological role [Term] id: CHEBI:78296 name: (3S)-3-ammonio-3-(3-chloro-4,5-dihydroxyphenyl)propanoyl residue subset: chebi_ph7_3 is_a: CHEBI:58942 ! amino-acid cation residue [Term] id: CHEBI:78297 name: (3S)-3-ammonio-3-(3-chloro-4-hydroxyphenyl)propanoyl residue subset: chebi_ph7_3 is_a: CHEBI:58942 ! amino-acid cation residue [Term] id: CHEBI:78298 name: environmental contaminant is_a: CHEBI:51086 ! chemical role [Term] id: CHEBI:78299 name: environmental food contaminant is_a: CHEBI:78295 ! food component is_a: CHEBI:78298 ! environmental contaminant [Term] id: CHEBI:78301 name: dTDP-beta-L-rhodosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:78302 name: dTDP-2-deoxy-beta-L-fucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:78303 name: aclacinomycin S zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78311 name: 15-oxolipoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78312 name: 5,10-dihydrophenazine-1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78313 name: 5,10-dihydro-9-dimethylallylphenazine 1-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78314 name: 4-O-dimethylallyl-L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78318 name: pppGp(2'->5')A(5-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:78320 name: 2-hydroxypropanoic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid relationship: has_role CHEBI:83056 ! Daphnia magna metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:78324 name: baicalein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:49020 ! hormone antagonist relationship: has_role CHEBI:49023 ! prostaglandin antagonist relationship: has_role CHEBI:64995 ! EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor relationship: has_role CHEBI:64996 ! EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor [Term] id: CHEBI:78325 name: 13,14-dihydro-15-oxolipoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78326 name: 5-hydroxyxanthotoxin(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:78327 name: pseudobaptigenin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78328 name: scutellarein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:78329 name: 13,14-dihydrolipoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78338 name: wogonin(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:78340 name: 1-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145182 ! 1-O-(1Z-octadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78341 name: 1-(1Z-octadecenyl)-2-oleoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:78355 ! 1-(1Z-alkenyl)-2-acyl-sn-glycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78342 name: 1-(1Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:145182 ! 1-O-(1Z-octadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:77290 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78343 name: 1-(1Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:78355 ! 1-(1Z-alkenyl)-2-acyl-sn-glycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78345 name: D-ribofuranose-2,5-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:78346 name: D-ribofuranose 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:78347 name: 3-linalylflaviolin-2-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:78349 name: 3-sulfinopropionyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:78352 name: cyclooctat-9-en-7-ol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid [Term] id: CHEBI:78355 name: 1-(1Z-alkenyl)-2-acyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:65220 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoserine(1-) is_a: CHEBI:78882 ! 1-(alk-1-enyl)-2-acylglycero-3-phospho-L-serine(1-) [Term] id: CHEBI:78357 name: 9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:78358 name: Delta(4)-dafachronate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:78361 name: lichen metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:78366 name: EC 2.7.1.1 (hexokinase) inhibitor is_a: CHEBI:50916 ! lipid kinase inhibitor is_a: CHEBI:76881 ! EC 2.7.1.* (phosphotransferases with an alcohol group as acceptor) inhibitor [Term] id: CHEBI:78367 name: 1-hexadecyl-2-propionyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78368 name: 1-hexadecyl-2-butanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:78369 name: 1-hexadecyl-2-succinyl-sn-glycero-3-phosphocholine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78370 name: cyclooctatin subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:38032 ! carbotricyclic compound relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:78372 ! EC 3.1.1.5 (lysophospholipase) inhibitor [Term] id: CHEBI:78371 name: 1-hexadecyl-2-glutaryl-sn-glycero-3-phosphocholine(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78372 name: EC 3.1.1.5 (lysophospholipase) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:78375 name: N(5)-phenyl-L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78376 name: 2-hydroxy-7-methoxy-5-methyl-1-naphthoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:78377 name: EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor is_a: CHEBI:76857 ! EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:78378 name: 2-deoxy-alpha-L-fucosylaclacinomycin S zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:78379 name: EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:78385 name: 1-palmityl-2-acetyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73332 ! 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:78387 name: 1-hexadecyl-2-acetyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:60520 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78390 name: 1-hexadecyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:76168 ! 1-alkyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78396 name: 4-hydroxy-3-polyprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:22718 ! benzoates [Term] id: CHEBI:78402 name: 1-oleyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58014 ! 1-alkyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78415 name: trioxilin anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:78419 name: 1-(Z)-alk-1-enyl-2-acetyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78218 ! 1-(alk-1-enyl)-2-acetyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:78421 name: 1-oleoyl-2-acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78423 name: (R)-11-hydroxylaurate(1-) subset: chebi_ph7_3 is_a: CHEBI:76628 ! 11-hydroxylaurate [Term] id: CHEBI:78424 name: 18-hydroxyoleate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:78426 name: 1-(3-O-sulfo-beta-D-galactosyl-(1->4)-beta-D-glucosyl)-N-acylsphingosine(1-) subset: chebi_ph7_3 is_a: CHEBI:90163 ! beta-D-3-sulfogalactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) [Term] id: CHEBI:78428 name: 1-alkyl-2-acyl-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid is_a: CHEBI:83262 ! alkyl,acyl-3-(beta-D-galactosyl)-sn-glycerol [Term] id: CHEBI:78429 name: 1-alkyl-2-acyl-3-(3-O-sulfo-beta-D-galactosyl)-sn-glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:166904 ! glycosyldiradylglycerol is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:78430 name: 1,2-diacyl-3-(3-O-sulfo-beta-D-galactosyl)glycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:78433 name: refrigerant is_a: CHEBI:33232 ! application [Term] id: CHEBI:78435 name: [GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n-diphospho-ditrans,polycis-undecaprenol polyanion subset: chebi_ph7_3 is_a: CHEBI:61469 ! polyanionic polymer [Term] id: CHEBI:78436 name: ganglioside GD3(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:78437 is_obsolete: true replaced_by: CHEBI:78436 [Term] id: CHEBI:78438 name: alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(3-) subset: chebi_ph7_3 is_a: CHEBI:79216 ! alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(3-) is_a: CHEBI:88075 ! trisialodiglycosylceramide(3-) [Term] id: CHEBI:78440 name: S-methyl-5-thio-D-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:26976 ! thioribose is_a: CHEBI:86315 ! methyl sulfide [Term] id: CHEBI:78442 name: AMP 3'-end(1-) residue subset: chebi_ph7_3 is_a: CHEBI:74896 ! 3'-end ribonucleotide(1-) residue [Term] id: CHEBI:78444 name: EC 3.1.1.1 (carboxylesterase) inhibitor is_a: CHEBI:76773 ! EC 3.1.1.* (carboxylic ester hydrolase) inhibitor [Term] id: CHEBI:78445 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(2-) subset: chebi_ph7_3 is_a: CHEBI:82637 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) is_a: CHEBI:88057 ! ganglioside GD1(2-) [Term] id: CHEBI:78446 name: O-(S-acetylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78447 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88058 ! ganglioside GT1(3-) is_a: CHEBI:90501 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(3-) [Term] id: CHEBI:78449 name: O-(S-malonylpantetheine-4'-phosphoryl)serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78450 name: O-(S-acetoacetylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78451 name: O-[S-(3R)-hydroxybutanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78452 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:79220 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(2-) is_a: CHEBI:82940 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) is_a: CHEBI:88058 ! ganglioside GT1(3-) [Term] id: CHEBI:78453 name: O-[S-(2E)-butenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78454 name: O-(S-butanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78455 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1)(4-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88059 ! ganglioside GQ1(4-) is_a: CHEBI:90862 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(4-) [Term] id: CHEBI:78456 name: O-(S-3-oxohexanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78457 name: O-[S-(3R)-hydroxyhexanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78458 name: O-[S-(2E)-hexenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78459 name: O-(S-hexanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78460 name: O-(S-3-oxooctanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78461 name: O-[S-(3R)-hydroxyoctanoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78462 name: O-[S-(2E)-octenoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78463 name: O-(S-octanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78464 name: O-(S-3-oxodecanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78466 name: O-[S-(3R)-hydroxydecanoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78467 name: O-[S-(2E)-decenoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78468 name: O-(S-decanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78469 name: O-(S-3-oxododecanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78470 name: O-[S-(3R)-hydroxydodecanoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78472 name: O-[S-(2E)-dodecenoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78473 name: O-(S-3-oxotetradecanoylpantetheine-4-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78474 name: O-[S-(3R)-hydroxytetradecanoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78475 name: O-[S-(2E)-tetradecenoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78477 name: O-(S-tetradecanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78478 name: O-(S-3-oxohexadecanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78480 name: O-[S-(3R)-hydroxyhexadecanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78481 name: O-[S-(2E)-hexadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78482 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosylceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:82643 ! N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1<->1')-ceramide(1-) is_a: CHEBI:88068 ! monosialomonoglycosylceramide(1-) [Term] id: CHEBI:78483 name: O-(S-hexadecanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78484 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-stearoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:27938 ! beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer [Term] id: CHEBI:78485 name: ganglioside GM2 (18:0) (1-) subset: chebi_ph7_3 is_a: CHEBI:71502 ! beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:78486 name: N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-stearoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:27731 ! N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide [Term] id: CHEBI:78487 name: O-(S-3-oxooctadecanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78488 name: O-[S-(3R)-hydroxyoctadecanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78489 name: O-[S-(2E)-octadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue is_a: CHEBI:78784 ! O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue [Term] id: CHEBI:78494 name: 3'-(L-leucyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78495 name: O-(S-octadecanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78497 name: 3'-(L-alanyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78499 name: C-terminal-gamma-L-glutamyl-L-2-aminoadipate 6-phosphate(4-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:78501 name: C-terminal-gamma-L-glutamyl-L-2-aminoadipate semialdehyde(2-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:78502 name: (S)-2-aminopropan-1-ol is_a: CHEBI:195477 ! 2-aminopropan-1-ol [Term] id: CHEBI:78503 name: C-terminal-gamma-L-glutamyl-L-2-aminoadipate(3-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:78512 name: 1-decanoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:78513 name: 3'-(L-arginyl)adenylyl(1+) group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:78515 name: 3'-(L-asparaginyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78516 name: 3'-(L-aspartate)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78517 name: 3'-(L-cysteinyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78520 name: 3'-(L-glutamate)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78521 name: 3'-(L-glutaminyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78522 name: 3'-glycyladenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group is_a: CHEBI:78442 ! AMP 3'-end(1-) residue [Term] id: CHEBI:78525 name: L-glutamo(2-) group subset: chebi_ph7_3 is_a: CHEBI:90782 ! C-terminal proteinogenic amino-acid residue(1-) [Term] id: CHEBI:78526 name: C-terminal-gamma-L-glutamyl-L-lysine(1-) group subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:78527 name: 3'-(L-histidyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78528 name: 3'-(L-isoleucyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78529 name: 3'-(L-lysyl)adenylyl(1+) group subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:78530 name: 3'-(L-methionyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78531 name: 3'-(L-phenylalanyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78532 name: 3'-(L-prolyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78533 name: 3'-(L-seryl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78534 name: 3'-(L-threonyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78535 name: 3'-(L-tryptophyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78536 name: 3'-(L-tyrosyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78537 name: 3'-(L-valyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78541 name: 1-hexadecyl-2-amino-2-deoxy-sn-glycerol is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:25698 ! ether [Term] id: CHEBI:78542 name: beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:88077 ! disialotriglycosylceramide(2-) [Term] id: CHEBI:78547 name: protein kinase A agonist is_a: CHEBI:64106 ! protein kinase agonist [Term] id: CHEBI:78548 name: adenylate cyclase agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:78551 name: 3'-(O-phosphonato-L-seryl)adenylyl(2-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78552 name: ribonucleoside 2'-monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:78554 name: 2-methyl-3-hydroxybutyrate subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:78556 name: 3'-(L-pyrrolysyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78559 name: (2S,3S)-3-hydroxy-2-methylbutanoate subset: chebi_ph7_3 is_a: CHEBI:78554 ! 2-methyl-3-hydroxybutyrate [Term] id: CHEBI:78565 name: beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)- beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:144748 ! beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:36642 ! glycohexaosylceramide [Term] id: CHEBI:78566 name: 1-(1Z)-alkenyl-2-acetyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:77286 ! 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:78568 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88056 ! ganglioside GM1/1b(1-) is_a: CHEBI:90151 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) [Term] id: CHEBI:78569 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:88057 ! ganglioside GD1(2-) is_a: CHEBI:90246 ! alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-Cer(2-) [Term] id: CHEBI:78571 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:141724 ! N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88058 ! ganglioside GT1(3-) [Term] id: CHEBI:78572 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(4-) subset: chebi_ph7_3 is_a: CHEBI:141711 ! N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(4-) is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88059 ! ganglioside GQ1(4-) [Term] id: CHEBI:78573 name: 3'-(L-selenocysteinyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78574 name: pyrimidinecarboxylic acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:39447 ! pyrimidines [Term] id: CHEBI:78588 name: 6-linalyl-2-O,3-dimethylflaviolin-7-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:78589 name: 2-O,3-dimethylflaviolin-7-olate subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:78590 name: 7-O-geranyl-2-O,3-dimethylflaviolin subset: chebi_ph7_3 is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78594 name: 5alpha-pregan-20beta-ol-3-one subset: chebi_ph7_3 is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:36854 ! 20-hydroxy steroid [Term] id: CHEBI:78595 name: 21-dehydrocortisol subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:36886 ! 21-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:78596 name: 21-dehydrocortisone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:36886 ! 21-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:78597 name: N-terminal alpha-amino-acid(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:78598 name: N-acetylamino-acid residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:78599 name: (gamma-L-glutamyl) N-terminal alpha-amino-acid zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:78600 name: 11-dehydrocorticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50858 ! corticosteroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78601 name: 11,21-dioxoprogesterone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:36886 ! 21-oxo steroid is_a: CHEBI:47787 ! 11-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:78602 name: isoursodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:78603 name: 3beta-hydroxy-7-oxo-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:78604 name: ursodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78605 name: 7-oxolithocholate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:78607 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:90189 ! alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-Cer(1-) [Term] id: CHEBI:78608 name: alpha-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:78611 name: 3-hydroxybutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:78612 name: C-terminal L-Cys-L-Leu-L-Val-L-Cys(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78613 name: C-terminal L-Ala-L-Leu-L-valinamide-N-CH=CH-S residue subset: chebi_ph7_3 is_a: CHEBI:33456 ! organoheteryl group [Term] id: CHEBI:78616 name: carbohydrates and carbohydrate derivatives is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:78619 name: iron(III) oxide-hydroxide(1-) subset: chebi_ph7_3 is_a: CHEBI:79389 ! monovalent inorganic anion [Term] id: CHEBI:78620 name: 3-methoxy-5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78624 is_obsolete: true replaced_by: CHEBI:143093 [Term] id: CHEBI:78625 name: clavaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78628 name: 2-hydroxyglutaryl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:78629 name: N-(6-aminohexanoyl)-6-aminohexanoic acid zwitterion monomer subset: chebi_ph7_3 is_a: CHEBI:53368 ! ionic macromolecule [Term] id: CHEBI:78630 name: 9-cis-retinoate subset: chebi_ph7_3 is_a: CHEBI:15036 ! retinoate relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50176 ! keratolytic drug relationship: has_role CHEBI:63794 ! retinoid X receptor agonist [Term] id: CHEBI:78631 name: chroman-6-ol subset: chebi_ph7_3 is_a: CHEBI:23229 ! chromanol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:78636 name: vitexin 2''-O-beta-L-rhamnoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78640 name: 7-O-methylvitexin 2''-O-beta-L-rhamnoside(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78646 name: N-hexadecanoylsphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:106304 ! sphingomyelin d18:1/16:0 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:78647 name: N-hexadecanoylsphinganine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:67090 ! N-acylsphinganine-1-phosphocholine is_a: CHEBI:72513 ! sphingomyelin 34:0 relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78650 name: N-hexadecanoylphytosphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:72513 ! sphingomyelin 34:0 is_a: CHEBI:78651 ! N-acylphytosphingosine-1-phosphocholine [Term] id: CHEBI:78651 name: N-acylphytosphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64583 ! sphingomyelin [Term] id: CHEBI:78654 name: N-hexadecanoylsphinganine-1-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78655 ! N-acylsphinganine-1-phosphoethanolamine zwitterion [Term] id: CHEBI:78655 name: N-acylsphinganine-1-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:73202 ! ceramide phosphoethanolamine zwitterion [Term] id: CHEBI:78656 name: N-hexadecanoylphytosphingosine-1-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:78657 ! N-acylphytosphingosine-1-phosphoethanolamine zwitterion [Term] id: CHEBI:78657 name: N-acylphytosphingosine-1-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:73202 ! ceramide phosphoethanolamine zwitterion [Term] id: CHEBI:78662 name: 2,3-epoxysqualene subset: chebi_ph7_3 is_a: CHEBI:26747 ! squalene triterpenoid is_a: CHEBI:32955 ! epoxide [Term] id: CHEBI:78663 name: (5Z,11Z,14Z)-icosatrienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:78664 name: (5Z,11Z,14Z,17Z)-icosatetraenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:78666 name: 5beta-pregnan-20alpha-ol-3-one subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:36854 ! 20-hydroxy steroid [Term] id: CHEBI:78670 name: (8Z,11Z)-icosadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:78675 name: fundamental metabolite is_a: CHEBI:25212 ! metabolite [Term] id: CHEBI:78679 name: D-ribose 5-phosphate is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:78680 name: (9Z,12Z)-tetradecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:78682 name: D-fructose 1,6-bisphosphate is_a: CHEBI:24970 ! ketohexose bisphosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:78684 name: (9Z,12Z)-pentadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:78686 name: Delta(4)-dafachronic acid is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:78698 ! dafachronic acids [Term] id: CHEBI:78687 name: D-fructofuranose 2,6-bisphosphate is_a: CHEBI:24970 ! ketohexose bisphosphate [Term] id: CHEBI:78688 name: 2,4-diacetylphloroglucinol is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:46640 ! diketone is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:78690 name: (9Z,12Z)-heptadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:78691 name: EC 2.3.1.97 (glycylpeptide N-tetradecanoyltransferase) inhibitor is_a: CHEBI:76878 ! EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor [Term] id: CHEBI:78697 name: D-fructose 6-phosphate is_a: CHEBI:88003 ! fructose 6-phosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:78698 name: dafachronic acids is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26764 ! steroid hormone is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:78699 name: Delta(7)-dafachronic acid is_a: CHEBI:71598 ! 3-oxo Delta(7)-steroid is_a: CHEBI:78698 ! dafachronic acids relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:78700 name: 9-oxononanoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:76328 ! omega-oxo fatty acid relationship: has_role CHEBI:70722 ! EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor [Term] id: CHEBI:78703 name: 2-arachidonoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:37646 ! 2-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:78709 name: 3-deoxy-D-threo-hex-2-ulosaric acid is_a: CHEBI:63438 ! hexaric acid derivative [Term] id: CHEBI:78712 name: tetrahydropyrimidine is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:78715 name: 1,4,5,6-tetrahydropyrimidines is_a: CHEBI:78712 ! tetrahydropyrimidine [Term] id: CHEBI:78717 name: UDP-alpha-D-galactosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:78718 name: UDP-alpha-D-glucosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:7872 name: oxytocin is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25905 ! peptide hormone relationship: has_role CHEBI:35620 ! vasodilator agent relationship: has_role CHEBI:36063 ! oxytocic [Term] id: CHEBI:78723 name: 3'-(D-tyrosyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78728 name: EC 1.3.1.72 (Delta(24)-sterol reductase) inhibitor is_a: CHEBI:76857 ! EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD(+) or NADP(+) as acceptor) inhibitor [Term] id: CHEBI:78730 name: 9(R)-HODE is_a: CHEBI:72651 ! 9-HODE [Term] id: CHEBI:78731 name: 9(R)-HPETE is_a: CHEBI:78732 ! 9-HPETE [Term] id: CHEBI:78732 name: 9-HPETE is_a: CHEBI:24644 ! HPETE [Term] id: CHEBI:78734 name: tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate is_a: CHEBI:36243 ! propanoate ester is_a: CHEBI:37332 ! tropane alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78736 name: D-fructose 1-phosphate is_a: CHEBI:78737 ! fructose 1-phosphate [Term] id: CHEBI:78737 name: fructose 1-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:78741 name: oxidopamine is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:33567 ! catecholamine is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:50910 ! neurotoxin relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78762 name: 1-oleoyl-sn-glycero-3-phospho-D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:64771 ! 1-acyl-sn-glycero-3-phospho-1D-myo-inositol(1-) is_a: CHEBI:74466 ! lysophosphatidylinositol 18:1(1-) [Term] id: CHEBI:78765 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:75243 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1-) [Term] id: CHEBI:78768 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:78771 name: ascarylopyranose subset: chebi_ph7_3 is_a: CHEBI:30944 ! ascarylose is_a: CHEBI:38131 ! lactol [Term] id: CHEBI:78772 name: alpha-ascarylopyranose subset: chebi_ph7_3 is_a: CHEBI:78771 ! ascarylopyranose [Term] id: CHEBI:78776 name: O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78778 name: O-[S-(11Z)-hexadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78779 name: O-[S-(13Z)-3-oxooctadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78783 name: O-(S-oleoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78784 name: O-[S-(2E)-2-enoylpantetheine-4'-phosphoryl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78785 name: O-(S-2,3-saturated acylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78795 name: pentadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78122 ! fatty acid anion 15:0 relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78796 name: nonadecanoate subset: chebi_ph7_3 is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:78892 ! fatty acid anion 19:0 relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:78798 name: O-[S-(3Z)-decenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78802 name: diarylheptanoid is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:33836 ! benzenoid aromatic compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:78803 name: nematode metabolite is_a: CHEBI:75767 ! animal metabolite [Term] id: CHEBI:78804 name: Caenorhabditis elegans metabolite is_a: CHEBI:78803 ! nematode metabolite [Term] id: CHEBI:78808 name: (9Z)-hexacosenoate subset: chebi_ph7_3 is_a: CHEBI:78055 ! hexacosenoate [Term] id: CHEBI:78809 name: N(6)-octanoyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:189854 ! N(6)-(fatty acyl)-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:78810 name: 1-oleoyl-2-palmitoleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71721 ! phosphatidylethanolamine 34:2 zwitterion [Term] id: CHEBI:78811 name: heptanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:78812 name: ascr#2 subset: chebi_ph7_3 is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:79201 ! hydroxy ketone ascaroside relationship: has_role CHEBI:26013 ! pheromone relationship: has_role CHEBI:78804 ! Caenorhabditis elegans metabolite [Term] id: CHEBI:78813 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71720 ! phosphatidylethanolamine 34:1 zwitterion [Term] id: CHEBI:78814 name: 1-oleoyl-2-myristoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71712 ! phosphatidylethanolamine 32:1 zwitterion is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:78815 name: N(6)-(S(8)-acetyldihydrolipoyl)-L-lysine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:78816 name: 5-hydroxyhexan-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:78817 name: (5R)-5-hydroxyhexan-2-one subset: chebi_ph7_3 is_a: CHEBI:78816 ! 5-hydroxyhexan-2-one [Term] id: CHEBI:78818 name: O-(S-3-oxopentanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78820 name: O-(S-3-oxo-4-methylpentanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78822 name: O-(S-3-oxo-5-methylhexanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78823 name: O-(S-3-oxo-4-methylhexanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78824 name: O-(S-3-oxoheptanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78826 name: O-(S-3-oxononanoylpantetheine-4'-phosphoryl)serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:78827 name: O-[S-(3R)-3-hydroxyacylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:7883 name: PR-toxin subset: chebi_ph7_3 is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:78832 name: (5Z,8Z,11Z,13E)-15-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:78833 name: 11-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:78836 name: 11(R)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:78833 ! 11-HETE(1-) [Term] id: CHEBI:78837 name: 15(R)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:78832 ! (5Z,8Z,11Z,13E)-15-HETE(1-) [Term] id: CHEBI:78840 name: olefinic compound is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:78844 name: 3'-(N-formyl-L-methionyl)adenylyl(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:78845 name: O-[S-(methoxycarbonylacetyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78846 name: O-(S-pimeloylpantetheine-4'-phosphoryl)serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:78847 name: UDP-2,3-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:137179 ! UDP-2,3-diacyl-alpha-D-glucosamine(2-) [Term] id: CHEBI:78856 name: 2-methyl-1-pyrroline is_a: CHEBI:23763 ! pyrroline is_a: CHEBI:24783 ! imine [Term] id: CHEBI:78858 name: (R)-2-methylpyrrolidine is_a: CHEBI:145240 ! 2-methylpyrrolidine [Term] id: CHEBI:78859 name: 12(S)-HPE(5,8,10)TrE is_a: CHEBI:136627 ! hydroperoxyicosatrienoic acid [Term] id: CHEBI:78860 name: 12(S)-HPE(8,10,14)TrE is_a: CHEBI:84174 ! 12-HPE(8,10,14)TrE [Term] id: CHEBI:78861 name: 14(S)-HPDHE is_a: CHEBI:84177 ! 14-HPDHE [Term] id: CHEBI:78862 name: tetracosapentaenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78863 name: hexacosapentaenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78864 name: hexacosatetraenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78865 name: hexacosenoic acid is_a: CHEBI:25413 ! monounsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78866 name: hexacosahexaenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78867 name: tetracosatetraenoic acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:27283 ! very long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78868 name: octacosatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78869 name: octacosapentaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78882 name: 1-(alk-1-enyl)-2-acylglycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:78224 ! 1-alkyl-2-acylglycero-3-phosphoserine(1-) [Term] id: CHEBI:78892 name: fatty acid anion 19:0 subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:78896 name: tetradecenoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:78902 name: L-canavanine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:78903 name: mannoprotein is_a: CHEBI:17089 ! glycoprotein relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:78904 name: 4,4-dimethyl-8,14-cholestadien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:78907 name: 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:60110 ! 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate(3-) [Term] id: CHEBI:78908 name: 10(R)-HPO(6,8,12)TrE is_a: CHEBI:84180 ! 10-HPO(6,8,12)TrE [Term] id: CHEBI:78909 name: 12-HPEPE is_a: CHEBI:138392 ! hydroperoxyicosapentaenoic acid relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor [Term] id: CHEBI:78911 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:78915 name: triacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78917 name: triacontahexaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78918 name: dotriacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78919 name: dotriacontahexaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78920 name: dotriacontapentaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78929 name: N-hexadecanoylphosphatidylethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:78930 name: 1-acyl-2-hexanoyl-sn-glycero-3-phospho-(1'-D-myo-inositol-5'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:78931 name: 1-acyl-2-hexanoyl-sn-glycero-3-phospho-(1'-D-myo-inositol)(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:78932 name: tetratriacontapentaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78933 name: tetratriacontahexaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78934 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1'-D-myo-inositol-3'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:58088 ! 1-phosphatidyl-1D-myo-inositol 3-phosphate(3-) [Term] id: CHEBI:78935 name: hexatriacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78936 name: hexatriacontapentaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78937 name: hexatriacontahexaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78938 name: octatriacontatetraenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78939 name: octatriacontapentaenoic acid is_a: CHEBI:143004 ! ultra-long-chain fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:78940 name: N-palmitoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:78947 name: archaeal metabolite is_a: CHEBI:75787 ! prokaryotic metabolite [Term] id: CHEBI:78948 name: L-2-amino-3-oxobutanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:78954 name: (omega-1)-hydroxy fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:7896 name: hexadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76619 ! omega-methyl fatty acid anion is_a: CHEBI:78123 ! fatty acid anion 16:0 is_a: CHEBI:83955 ! 2-saturated fatty acid anion relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:78978 name: (11R)-11-hydroxylauric acid is_a: CHEBI:76937 ! 11-hydroxylauric acid [Term] id: CHEBI:78981 name: UDP-2-acetamido-2-deoxy-3-dehydro-alpha-D-glucopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:78983 name: O-[S-(3R)-hydroxypentanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78985 name: O-[S-(3R)-hydroxy-4-methylhexanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78986 name: O-[S-(3R)-hydroxy-5-methylhexanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78987 name: O-[S-(3R)-hydroxyheptanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78988 name: O-[S-(3R)-hydroxynonanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:78993 name: 1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:78994 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'-D-myo-inositol-3',5'-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:57923 ! 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5-) [Term] id: CHEBI:78995 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'D-myo-inositol-3'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:58088 ! 1-phosphatidyl-1D-myo-inositol 3-phosphate(3-) is_a: CHEBI:78993 ! 1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate)(3-) [Term] id: CHEBI:79005 name: diphthine methyl ester residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:79007 name: tricosanoate subset: chebi_ph7_3 is_a: CHEBI:58950 ! very long-chain fatty acid anion is_a: CHEBI:58954 ! straight-chain saturated fatty acid anion is_a: CHEBI:88081 ! fatty acid anion 23:0 [Term] id: CHEBI:79008 name: (R)-nicotinium(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:79010 name: prostaglandin D1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:79020 name: alpha,beta-unsaturated monocarboxylic acid is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:79021 name: (11Z)-3-oxohexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:84947 ! (11Z)-Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:79031 name: dihydromonacolin L carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79032 name: O-[S-(dihydromonacolin L carboxy)pantetheine-4'-phosphoryl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:79034 name: monacolin J subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:75885 ! 2-pyranones relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:79035 name: monacolin J carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79036 name: 3alpha-hydroxy-3,5-dihydromonacolin L carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79038 name: mevinolinate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79044 name: monacolin L carboxylate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79047 name: D-mannopyranuronic acid is_a: CHEBI:33076 ! D-mannonic acid [Term] id: CHEBI:79048 name: L-glucuronic acid is_a: CHEBI:24298 ! glucuronic acid [Term] id: CHEBI:79049 name: L-glucopyranuronic acid is_a: CHEBI:79048 ! L-glucuronic acid [Term] id: CHEBI:79054 name: D-arabinofuranose subset: chebi_ph7_3 is_a: CHEBI:17108 ! D-arabinose [Term] id: CHEBI:79056 name: plasticiser is_a: CHEBI:33232 ! application [Term] id: CHEBI:79057 name: hercynylcysteine sulfoxide is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:83824 ! L-cysteine derivative is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:79058 name: D-arabinose 5-phosphate is_a: CHEBI:22600 ! arabinose phosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:79059 name: 2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:17936 ! 2-acyl-sn-glycero-3-phosphate relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:79063 name: 4,4'-diapolycopenedioate subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:79064 name: 4,4'-diaponeurosporenoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:79065 name: 4,4'-diaponeurosporenal subset: chebi_ph7_3 is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:51688 ! enal [Term] id: CHEBI:79066 name: 4-O-beta-D-glucosyl-trans-4-coumarate subset: chebi_ph7_3 is_a: CHEBI:47893 ! 4-O-beta-D-glucosyl-4-coumarate [Term] id: CHEBI:79067 name: 1-hexanoyl-sn-glycero-3-phosphate is_a: CHEBI:16975 ! 1-acyl-sn-glycerol 3-phosphate is_a: CHEBI:87656 ! hexanoate ester [Term] id: CHEBI:79068 name: crocin-1 subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:51307 ! diester is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77178 ! histological dye relationship: has_role CHEBI:77182 ! food colouring [Term] id: CHEBI:79070 name: hercynylselenocysteine is_a: CHEBI:26629 ! selenoamino acid is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:79071 name: selenoneine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:79072 name: 15-ketoprostaglandin F1alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:79074 name: 1,2-dicapryl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:79075 name: 1,2-dioctanoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:79076 name: 3-methyl-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:79077 name: 5-hydroxy-3-methyl-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:79079 name: (4S)-4-hydroxy-L-isoleucine is_a: CHEBI:22478 ! amino alcohol is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:84111 ! L-isoleucine derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:79080 name: lactose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:79081 name: cyclic 2,3-bisphospho-D-glycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:79082 name: 5-methyl-1-naphthoic acid is_a: CHEBI:25483 ! naphthoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79083 name: 3-hydroxy-5-methyl-1-naphthoic acid is_a: CHEBI:25392 ! naphthols is_a: CHEBI:25483 ! naphthoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79084 name: tricyclic diterpenoid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:51959 ! organic tricyclic compound [Term] id: CHEBI:79091 name: EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor is_a: CHEBI:37699 ! protein kinase inhibitor is_a: CHEBI:76812 ! EC 2.7.11.* (protein-serine/threonine kinase) inhibitor [Term] id: CHEBI:79095 name: N(5)-hydroxy-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:79096 name: 1-stearoyl-2-oleoyl-sn-glycero-3-phosphoserine is_a: CHEBI:90433 ! phosphatidylserine(18:0/18:1) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:79097 name: 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:79098 name: 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:79099 name: 1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:17476 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:791 name: 17beta-estradiol 17-glucosiduronic acid is_a: CHEBI:26763 ! steroid glucosiduronic acid is_a: CHEBI:36834 ! 3-hydroxy steroid [Term] id: CHEBI:79102 name: 1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine is_a: CHEBI:65240 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:79103 name: 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoserine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:79109 name: 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:79110 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:79113 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoserine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:79122 name: 2,7-dihydroxy-5-methyl-1-naphthoic acid is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:25483 ! naphthoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79125 name: 2-hydroxy-7-methoxy-5-methyl-1-naphthoic acid is_a: CHEBI:25392 ! naphthols is_a: CHEBI:25483 ! naphthoic acid is_a: CHEBI:48851 ! methoxynaphthalene relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:7916 name: pantothenic acid is_a: CHEBI:25848 ! pantothenic acids relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:79169 name: 15-hydroxypentadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:39418 ! straight-chain saturated fatty acid [Term] id: CHEBI:79171 name: dTDP-beta-L-rhodosamine is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:79172 name: 2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:79173 name: dTDP-2-deoxy-beta-L-fucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:79174 name: 2,2',3-trihydroxydiphenyl ether(2-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:79176 name: aclacinomycin S is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:51286 ! tetracenequinones is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79181 name: 5,10-dihydrophenazine-1-carboxylic acid is_a: CHEBI:33859 ! aromatic carboxylic acid is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79182 name: 18-hydroxyoctadecanoic acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid relationship: has_role CHEBI:68495 ! apoptosis inducer [Term] id: CHEBI:79183 name: 5,10-dihydro-9-dimethylallylphenazine-1-carboxylic acid is_a: CHEBI:33859 ! aromatic carboxylic acid is_a: CHEBI:39201 ! phenazines is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79185 name: 4-O-dimethylallyl-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative [Term] id: CHEBI:79186 name: 3'-N-debenzoyl-2'-deoxytaxol(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:79187 name: pppGp(2'->5')A is_a: CHEBI:37124 ! guanosine bisphosphate is_a: CHEBI:75800 ! (2'->5')-dinucleotide [Term] id: CHEBI:79188 name: (3R)-3-ammonio-3-phenylpropanoyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:79189 name: D-ribofuranose-2,5-bisphosphate is_a: CHEBI:35158 ! ribose bisphosphate [Term] id: CHEBI:79191 name: L-Cys(IAN) zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:79192 name: 6-acetamido-2-oxohexanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:79193 name: 5-acetamidopentanoate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:79196 name: 3-linalylflaviolin is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:79199 name: 13,14-dihydrolipoxin A4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:23899 ! icosanoid is_a: CHEBI:73155 ! trienoic fatty acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:79200 name: (R)-dihydrocamalexate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:79201 name: hydroxy ketone ascaroside is_a: CHEBI:79202 ! ascaroside [Term] id: CHEBI:79202 name: ascaroside is_a: CHEBI:24400 ! glycoside is_a: CHEBI:35315 ! deoxy hexoside [Term] id: CHEBI:79203 name: 1-(1Z-octadecenyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine is_a: CHEBI:17476 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:79206 name: 1-(1Z-octadecenyl)-2-oleoyl-sn-glycero-3-phosphoserine is_a: CHEBI:65240 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:79207 name: 1-(1Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:17476 ! 1-(alk-1-enyl)-2-acyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:79208 name: beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide subset: chebi_ph7_3 is_a: CHEBI:63415 ! glycodiaosylceramide [Term] id: CHEBI:79209 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide is_a: CHEBI:36544 ! sialodiosylceramide [Term] id: CHEBI:79210 name: alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:79211 name: 1-(1Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphoserine is_a: CHEBI:65240 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:79213 name: alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide is_a: CHEBI:36544 ! sialodiosylceramide [Term] id: CHEBI:79214 name: alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:79215 name: alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide is_a: CHEBI:36544 ! sialodiosylceramide [Term] id: CHEBI:79216 name: alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(3-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:79217 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide is_a: CHEBI:36541 ! sialotriaosylceramide [Term] id: CHEBI:79218 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:79219 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide is_a: CHEBI:36541 ! sialotriaosylceramide [Term] id: CHEBI:79220 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:79221 name: 3-sulfinopropionyl-CoA is_a: CHEBI:17984 ! acyl-CoA relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79222 name: 3-sulfinopropionic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:37783 ! organosulfinic acid [Term] id: CHEBI:79246 name: 9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:79274 name: 1-hexadecyl-2-succinyl-sn-glycero-3-phosphocholine is_a: CHEBI:138979 ! hemisuccinate is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:79276 name: 1-hexadecyl-2-glutaryl-sn-glycero-3-phosphocholine is_a: CHEBI:36702 ! 2-acyl-1-alkyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:79277 name: 1-palmityl-2-acetyl-sn-glycero-3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:79280 name: 1-hexadecyl-2-acetyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:36712 ! 1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:79283 name: 1-hexadecyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:18244 ! 1-alkyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:79284 name: trehalulose subset: chebi_ph7_3 is_a: CHEBI:24407 ! glycosyl glycoside relationship: has_role CHEBI:50505 ! sweetening agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:79289 name: N(5)-phenyl-L-glutamine is_a: CHEBI:13248 ! anilide is_a: CHEBI:24317 ! L-glutamine derivative [Term] id: CHEBI:79293 name: 2-hydroxy-7-methoxy-5-methyl-1-naphthoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:79297 name: 2-deoxy-alpha-L-fucosylaclacinomycin S is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33853 ! phenols is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:79308 name: 1-oleyl-sn-glycero-3-phosphate is_a: CHEBI:17106 ! 1-alkyl-sn-glycerol 3-phosphate [Term] id: CHEBI:79312 name: 18-hydroxyoleic acid is_a: CHEBI:131869 ! hydroxy monounsaturated fatty acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:79313 name: glycosinolic acid is_a: CHEBI:25704 ! organic sulfate is_a: CHEBI:35275 ! S-glycosyl compound is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:79314 name: flame retardant is_a: CHEBI:33232 ! application [Term] id: CHEBI:79315 name: alkenylglucosinolic acid is_a: CHEBI:79316 ! glucosinolic acid [Term] id: CHEBI:79316 name: glucosinolic acid is_a: CHEBI:136440 ! beta-D-thioglucoside is_a: CHEBI:79313 ! glycosinolic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:79319 name: gluconapin is_a: CHEBI:79315 ! alkenylglucosinolic acid [Term] id: CHEBI:79322 name: thia-alkylglucosinolic acid is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:79327 ! alkylglucosinolic acid [Term] id: CHEBI:79327 name: alkylglucosinolic acid is_a: CHEBI:79316 ! glucosinolic acid [Term] id: CHEBI:7933 name: paromamine is_a: CHEBI:38751 ! triamine is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:79332 name: 1-alkyl-2-acyl-3-(3-O-sulfo-beta-D-galactosyl)-sn-glycerol is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:79333 name: 3'-(D-alpha-aminoacyl)adenylyl zwitterionic group subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:79337 name: 1,2-diacyl-3-(3-O-sulfo-beta-D-galactosyl)glycerol is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:7934 name: paromomycin is_a: CHEBI:22479 ! amino cyclitol glycoside is_a: CHEBI:22507 ! aminoglycoside antibiotic relationship: has_role CHEBI:35442 ! antiparasitic agent relationship: has_role CHEBI:35443 ! anthelminthic drug relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:36047 ! antibacterial drug [Term] id: CHEBI:79342 name: aralkylglucosinolic acid is_a: CHEBI:79316 ! glucosinolic acid [Term] id: CHEBI:79346 name: anionic ganglioside is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:79348 name: hydroxy-alkenylglucosinolic acid is_a: CHEBI:79316 ! glucosinolic acid [Term] id: CHEBI:79350 name: xi-progoitrin is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:79348 ! hydroxy-alkenylglucosinolic acid [Term] id: CHEBI:79352 name: progoitrin is_a: CHEBI:79350 ! xi-progoitrin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:79364 name: indolylmethylglucosinolic acid is_a: CHEBI:79316 ! glucosinolic acid [Term] id: CHEBI:79380 name: (2E,4Z)-2-hydroxy-7-methyl-6-oxo-2,4-octadienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:79383 name: 2-hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoic acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:52618 ! 2-hydroxy carboxylic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:79387 name: trivalent inorganic anion is_a: CHEBI:24834 ! inorganic anion [Term] id: CHEBI:79388 name: divalent inorganic anion is_a: CHEBI:24834 ! inorganic anion [Term] id: CHEBI:79389 name: monovalent inorganic anion is_a: CHEBI:24834 ! inorganic anion [Term] id: CHEBI:79392 name: EC 6.1.1.2 (tryptophan--tRNA ligase) inhibitor is_a: CHEBI:75416 ! EC 6.1.1.* (ligases forming aminoacyl tRNA and related compounds) inhibitor [Term] id: CHEBI:79394 name: indolmycin is_a: CHEBI:24828 ! indoles is_a: CHEBI:46812 ! 1,3-oxazoles is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:79392 ! EC 6.1.1.2 (tryptophan--tRNA ligase) inhibitor [Term] id: CHEBI:7940 name: patchouli alcohol subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:38032 ! carbotricyclic compound [Term] id: CHEBI:79516 name: Nonylphenol is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:798 name: 19-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36842 ! 19-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:799 name: 3,17-dioxoandrost-4-en-19-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:38149 ! 19-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:79985 name: flavanone 7-O-[alpha-L-rhamnosyl-(1->2)-beta-D-glucoside] subset: chebi_ph7_3 is_a: CHEBI:63353 ! disaccharide derivative is_a: CHEBI:72730 ! flavanone glycoside [Term] id: CHEBI:80 name: (-)-argemonine is_a: CHEBI:77060 ! 2,3,8,9-tetramethoxy-13-methyl-5,6,11,12-tetrahydro-5,11-epiminodibenzo[a,e][8]annulene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:80029 name: epothilone C subset: chebi_ph7_3 is_a: CHEBI:60831 ! epothilone [Term] id: CHEBI:8005 name: peptidoglycan is_a: CHEBI:86469 ! peptidoglycosaminoglycan [Term] id: CHEBI:8028 name: perphenazine is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:38093 ! phenothiazines is_a: CHEBI:46845 ! N-alkylpiperazine is_a: CHEBI:46851 ! N-(2-hydroxyethyl)piperazine relationship: has_role CHEBI:37930 ! phenothiazine antipsychotic drug relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:50919 ! antiemetic [Term] id: CHEBI:80291 name: aliphatic nitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile [Term] id: CHEBI:80308 name: substance P is_a: CHEBI:16670 ! peptide relationship: has_role CHEBI:194137 ! neurokinin-1 receptor agonist relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35620 ! vasodilator agent [Term] id: CHEBI:80448 name: OPC8-CoA is_a: CHEBI:72695 ! organic molecule [Term] id: CHEBI:80489 name: desmethylxanthohumol is_a: CHEBI:134339 ! 2-acyl-4-prenylphloroglucinol is_a: CHEBI:23086 ! chalcones relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:80535 name: methyl farnesoate subset: chebi_ph7_3 is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:4986 ! fatty acid methyl ester is_a: CHEBI:51702 ! enoate ester relationship: has_role CHEBI:83039 ! crustacean metabolite [Term] id: CHEBI:80536 name: juvenile hormone III acid is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:80545 name: indolylmethyl desulfoglucosinolate subset: chebi_ph7_3 is_a: CHEBI:136442 ! desulfoglucosinolic acid [Term] id: CHEBI:80651 name: 1,2-ditetradecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:85721 ! diacylglycerol 28:0 [Term] id: CHEBI:80656 name: all-trans-4-oxoretinoic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:80657 name: all-trans-18-hydroxyretinoic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:80658 name: 5,6-epoxyretinoic acid is_a: CHEBI:26537 ! retinoid is_a: CHEBI:32955 ! epoxide relationship: has_role CHEBI:139556 ! EC 4.1.1.17 (ornithine decarboxylase) inhibitor relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:80666 name: norbelladine is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33566 ! catechols is_a: CHEBI:38605 ! phenethylamine alkaloid is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:80667 name: 4'-O-methylnorbelladine is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:38605 ! phenethylamine alkaloid is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:80690 name: Thyroglobulin triiodothyronine subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:8075 name: phenoxyacetic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:35219 ! plant growth retardant relationship: has_role CHEBI:50904 ! allergen relationship: has_role CHEBI:76956 ! Aspergillus metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:80774 name: tauroursodeoxycholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68494 ! apoptosis inhibitor relationship: has_role CHEBI:77307 ! cardioprotective agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:80788 name: 1,4-cineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole is_a: CHEBI:46733 ! oxabicycloalkane relationship: has_role CHEBI:35488 ! central nervous system depressant relationship: has_role CHEBI:39277 ! fumigant insecticide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:80790 name: afzelin is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:50018 ! glycosyloxyflavone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:8087 name: N(2)-phenylacetylglutamine is_a: CHEBI:35735 ! dicarboxylic acid monoamide [Term] id: CHEBI:80946 name: 3-octanone subset: chebi_ph7_3 is_a: CHEBI:18044 ! dialkyl ketone relationship: has_role CHEBI:22583 ! antifeedant relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:80963 name: 3-(2'-Methylthio)ethylmalic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:80964 name: 3-(3'-Methylthio)propylmalic acid is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:80992 name: thiohydroximic acid is_a: CHEBI:33261 ! organosulfur compound is_a: CHEBI:35352 ! organonitrogen compound is_a: CHEBI:36963 ! organooxygen compound [Term] id: CHEBI:8100 name: 3-phenyllactate subset: chebi_ph7_3 is_a: CHEBI:58896 ! 2-hydroxy carboxylate [Term] id: CHEBI:81013 name: 7alpha,25-dihydroxy-4-cholesten-3-one subset: chebi_ph7_3 is_a: CHEBI:131619 ! C27-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:81014 name: 3beta-hydroxycholest-5-en-26-oic acid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81021 name: nocardicin C is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:50695 ! monobactam relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81022 name: isonocardicin C is_a: CHEBI:33853 ! phenols is_a: CHEBI:35692 ! dicarboxylic acid is_a: CHEBI:50695 ! monobactam is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81024 name: nocardicin G is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:50695 ! monobactam is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:8108 name: pheophytin is_a: CHEBI:38252 ! phorbines [Term] id: CHEBI:8113 name: phlorizin subset: chebi_ph7_3 is_a: CHEBI:28749 ! aryl beta-D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:71230 ! dihydrochalcones relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:8116 name: phorbol subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:52557 ! tetracyclic diterpenoid [Term] id: CHEBI:81200 name: (S)-corytuberine subset: chebi_ph7_3 is_a: CHEBI:134209 ! aporphine alkaloid is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:81240 name: ursocholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:27114 ! trihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:138390 ! EC 1.1.1.159 (7alpha-hydroxysteroid dehydrogenase) inhibitor relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:81243 name: alpha-muricholic acid is_a: CHEBI:134216 ! muricholic acids is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid [Term] id: CHEBI:81244 name: hyocholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:134216 ! muricholic acids is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81253 name: isolithocholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid is_a: CHEBI:36836 ! 3beta-hydroxy steroid relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81276 name: allodeoxycholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:138365 ! allo-bile acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81298 name: beta-muricholic acid is_a: CHEBI:134216 ! muricholic acids is_a: CHEBI:35349 ! 7beta-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid [Term] id: CHEBI:81308 name: allocholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:138365 ! allo-bile acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81403 name: 2-phosphinomethylmalic acid is_a: CHEBI:26044 ! phosphinic acids is_a: CHEBI:50263 ! 2-hydroxydicarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81405 name: N-Acetyldemethylphosphinothricin is_a: CHEBI:51569 ! N-acyl-amino acid [Term] id: CHEBI:81461 name: dTDP-4-dehydro-2,3,6-trideoxy-alpha-D-glucose is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81462 name: dTDP-4-amino-2,3,4,6-tetradeoxy-alpha-D-glucose is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81463 name: dTDP-alpha-D-forosamine is_a: CHEBI:61109 ! pyrimidine nucleotide-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81467 name: 7alpha-hydroxypregnenolone subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid relationship: has_role CHEBI:48560 ! dopaminergic agent relationship: has_role CHEBI:66980 ! nootropic agent relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81471 name: 7alpha-hydroxydehydroepiandrosterone subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81474 name: N-Acetyl-alpha-D-hexosamine 1-phosphate is_a: CHEBI:33447 ! phospho sugar [Term] id: CHEBI:81481 name: 11beta-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:81485 name: osthenol subset: chebi_ph7_3 is_a: CHEBI:37912 ! hydroxycoumarin relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:81544 name: 3-(1-hydroxyethyl)bacteriochlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81545 name: 3-(1-hydroxyethyl)chlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81546 name: bacteriochlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81548 name: 3-vinylbacteriochlorophyllide d is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81551 name: bacteriochlorophyllide d is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:81552 name: bacteriochlorophyllide c is_a: CHEBI:38206 ! chlorophyllide [Term] id: CHEBI:81559 name: resolvin E1 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:27136 ! triol is_a: CHEBI:61703 ! nonclassic icosanoid relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:81562 name: 5S-Hydroperoxy-18R-HEPE is_a: CHEBI:24644 ! HPETE [Term] id: CHEBI:81563 name: 18(R)-HEPE is_a: CHEBI:72802 ! 18-HEPE relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:81564 name: resolvin D1 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:67079 ! anti-inflammatory agent [Term] id: CHEBI:81565 name: resolvin D2 is_a: CHEBI:132120 ! resolvin is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:27136 ! triol relationship: has_role CHEBI:63951 ! estrogen receptor agonist relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:74518 ! anti-obesity agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:81567 name: thyroid stimulating hormone is_a: CHEBI:17089 ! glycoprotein [Term] id: CHEBI:81646 name: Pretetramid is_a: CHEBI:26895 ! tetracyclines [Term] id: CHEBI:81666 name: 4-methyl-5-nitrocatechol subset: chebi_ph7_3 is_a: CHEBI:25566 ! nitrotoluene is_a: CHEBI:33566 ! catechols relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:81667 name: 2-hydroxy-5-methylquinone is_a: CHEBI:67273 ! monohydroxy-1,4-benzoquinones [Term] id: CHEBI:81671 name: (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-decaprenyl diphosphate is_a: CHEBI:53043 ! decaprenyl diphosphate [Term] id: CHEBI:81672 name: (2S)-methylsuccinyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:81873 name: 12-deoxynogalonic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46955 ! anthracenes is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:81874 name: nogalaviketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51270 ! tetracenes is_a: CHEBI:51286 ! tetracenequinones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:8191 name: all-trans-phytoene subset: chebi_ph7_3 is_a: CHEBI:26119 ! phytoene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:8210 name: pimara-8(14),15-diene subset: chebi_ph7_3 is_a: CHEBI:50062 ! pimaradiene [Term] id: CHEBI:82204 name: (4R)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:64274 ! 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:82207 name: (4S)-7-hydroxy-4-isopropenyl-7-methyloxepan-2-one subset: chebi_ph7_3 is_a: CHEBI:64274 ! 7-hydroxy-4-isopropenyl-7-methyloxepan-2-one [Term] id: CHEBI:8225 name: pinoresinol is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:25036 ! lignan is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:47790 ! furofuran [Term] id: CHEBI:82464 name: cis-9,10-epoxyoctadecanoic acid is_a: CHEBI:85661 ! 9,10-epoxyoctadecanoic acid [Term] id: CHEBI:82605 name: 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:82606 name: 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol)(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:82607 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82608 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82609 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82610 name: 6-linalyl-2-O,3-dimethylflaviolin is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82611 name: 2-O,3-dimethylflaviolin is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone is_a: CHEBI:33853 ! phenols is_a: CHEBI:47985 ! enol ether relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82612 name: S-methyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:82620 name: L-tyrosine-O-phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:82626 name: 15(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:82627 name: 15(R)-HPETE is_a: CHEBI:24644 ! HPETE [Term] id: CHEBI:82628 name: 11(R)-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:146291 ! 11-HPETE(1-) is_a: CHEBI:59720 ! HPETE anion [Term] id: CHEBI:82629 name: prostaglandin G2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion is_a: CHEBI:62933 ! oxylipin anion [Term] id: CHEBI:82631 name: N-threonyl-glycosylphosphatidylinositolethanolamine is_a: CHEBI:24409 ! glycosylphosphatidylinositolethanolamine [Term] id: CHEBI:82632 name: phytochrome chromophore is_a: CHEBI:23240 ! chromophore [Term] id: CHEBI:82633 name: N-acetyl-alpha-neuraminosyl-(2->3)-D-galactosylceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82635 name: 4-nitrophenyl acetate subset: chebi_ph7_3 is_a: CHEBI:140310 ! phenyl acetates is_a: CHEBI:35716 ! C-nitro compound [Term] id: CHEBI:82637 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82639 name: alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82643 name: N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82657 name: deoxyhypusine(2+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:82663 name: elemental iron is_a: CHEBI:24873 ! iron molecular entity is_a: CHEBI:33259 ! elemental molecular entity [Term] id: CHEBI:82678 name: 3beta-hydroxy-7-oxo-5beta-cholan-24-oic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid [Term] id: CHEBI:82679 name: 7-oxolithocholic acid is_a: CHEBI:25753 ! oxo-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid is_a: CHEBI:36835 ! 3alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:82680 name: monounsaturated fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion [Term] id: CHEBI:82681 name: 3-methoxy-5-methyl-1-naphthoic acid is_a: CHEBI:25483 ! naphthoic acid is_a: CHEBI:35618 ! aromatic ether relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82682 name: vitexin 2''-O-beta-L-rhamnoside is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:27116 ! trihydroxyflavone is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:82683 name: O-[2'-(5-phosphoribosyl)-3'-dephospho-CoA]-L-serine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82684 name: 7-O-methylvitexin 2''-O-beta-L-rhamnoside is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:25401 ! monomethoxyflavone is_a: CHEBI:38686 ! dihydroxyflavone is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:82685 name: Mo(=O)(=S)-molybdopterin cofactor(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:82687 name: 5-(2-hydroxyethyl)-1,3-thiazole subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38418 ! 1,3-thiazoles [Term] id: CHEBI:82693 name: 2-[(3S)-3-carboxylato-3-(methylammonio)propyl]-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:82695 name: 2-[(3S)-3-carboxylato-3-(dimethylammonio)propyl]-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:73745 ! 2-[3-carboxylato-3-(dimethylammonio)propyl]-L-histidine residue [Term] id: CHEBI:82696 name: diphthine betaine residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:82697 name: N-(ADP-alpha-D-ribosyl)diphthamide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82703 name: N(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:82705 name: hercynylselenocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:82706 name: hercynylcysteine sulfoxide zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:82707 name: ergothioneine thione form subset: chebi_ph7_3 is_a: CHEBI:139340 ! 1,3-dihydroimidazole-2-thiones is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:76206 ! xenobiotic metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:82710 name: S-alkyl-L-cysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:58717 ! S-substituted L-cysteine zwitterion [Term] id: CHEBI:82711 name: aryl thiol subset: chebi_ph7_3 is_a: CHEBI:29256 ! thiol [Term] id: CHEBI:82728 name: S-(5-histidyl)cysteine sulfoxide dizwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:8273 name: plumbagin subset: chebi_ph7_3 is_a: CHEBI:132157 ! hydroxy-1,4-naphthoquinone is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:25212 ! metabolite relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50847 ! immunological adjuvant [Term] id: CHEBI:82730 name: (7Z)-hexadecenoate subset: chebi_ph7_3 is_a: CHEBI:78095 ! hexadecenoate [Term] id: CHEBI:82732 name: N-hexadecanoylsphinganine-1-phosphoethanolamine is_a: CHEBI:82734 ! N-acylsphinganine-1-phosphoethanolamine [Term] id: CHEBI:82734 name: N-acylsphinganine-1-phosphoethanolamine is_a: CHEBI:73204 ! ceramide phosphoethanolamine [Term] id: CHEBI:82735 name: O-[S-(6-methoxycarbonylhexanoyl)pantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:82736 name: N-acylphytosphingosine-1-phosphoethanolamine is_a: CHEBI:73204 ! ceramide phosphoethanolamine [Term] id: CHEBI:82737 name: N-hexadecanoylphytosphingosine-1-phosphoethanolamine is_a: CHEBI:82736 ! N-acylphytosphingosine-1-phosphoethanolamine [Term] id: CHEBI:82740 name: (5Z,11Z,14Z)-icosatrienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82741 name: (5Z,11Z,14Z,17Z)-icosatetraenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82742 name: (8Z,11Z)-icosadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82743 name: 5-methylaminomethyl-2-selenouridine 5'-monophosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:82744 name: aliphatic aldoxime subset: chebi_ph7_3 is_a: CHEBI:22307 ! aldoxime [Term] id: CHEBI:82745 name: (9Z,12Z)-tetradecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82746 name: (9Z,12Z)-pentadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82747 name: (9Z,12Z)-heptadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:82748 name: cytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:90675 ! ribonucleotide residue(1-) [Term] id: CHEBI:82750 name: cholesteryl stearate subset: chebi_ph7_3 is_a: CHEBI:17002 ! cholesteryl ester relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82751 name: cholesteryl arachidonate subset: chebi_ph7_3 is_a: CHEBI:132006 ! cholesteryl icosatetraenoate relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82753 name: 1-oleoyl-sn-glycero-3-phospho-D-myo-inositol is_a: CHEBI:28914 ! 1-acyl-sn-glycero-3-phospho-D-myo-inositol [Term] id: CHEBI:82757 name: 2-hydroxy-5-methyl-1-naphthoate subset: chebi_ph7_3 is_a: CHEBI:25482 ! naphthoate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82759 name: (S)-3-acetyloctanal subset: chebi_ph7_3 is_a: CHEBI:24960 ! ketoaldehyde [Term] id: CHEBI:82762 name: 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:74577 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:82763 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:75112 ! 1-acyl-2-arachidonoyl-sn-glycero-3-phosphate [Term] id: CHEBI:82764 name: O-[S-2-methylbutanoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:82765 name: 1,2-dioctanoyl-sn-glycerol 3-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:59996 ! 1,2-diacyl-sn-glycerol 3-diphosphate(3-) [Term] id: CHEBI:82766 name: 2-O-(alpha-D-glucopyranosyl)glycerol subset: chebi_ph7_3 is_a: CHEBI:22390 ! alpha-D-glucoside is_a: CHEBI:24287 ! glucosylglycerol relationship: has_role CHEBI:25728 ! osmolyte relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82767 name: 4-(5-O-phosphonato-beta-D-ribofuranosyl)phenol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:82768 name: caldopentamine(5+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:82769 name: caldopentamine(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:82770 name: N(4)-aminopropylspermidine(4+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82771 name: N(4)-bis(aminopropyl)spermidine(5+) subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82772 name: N(4)-aminopropylspermine(5+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82773 name: (R)-3-phosphonatomevalonate(3-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:82774 name: (R)-3,5-bisphosphonatomevalonate(5-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:82775 name: 5'-deoxyinosine subset: chebi_ph7_3 is_a: CHEBI:24844 ! inosines is_a: CHEBI:36988 ! 5'-deoxyribonucleoside relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82795 name: gamma-methyl L-glutamate residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:82798 name: cembrene C subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:36402 ! cycloalkatriene is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82799 name: (R)-nephthenol subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:60687 ! cembrane diterpenoid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76498 ! coral metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82800 name: (R)-cembrene A subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene is_a: CHEBI:36402 ! cycloalkatriene is_a: CHEBI:51026 ! macrocycle relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76498 ! coral metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82801 name: (1S,4E,8E,12E)-2,2,5,9,13-pentamethylcyclopentadeca-4,8,12-trien-1-ol subset: chebi_ph7_3 is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36402 ! cycloalkatriene is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:82803 name: opine is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:82810 name: N-palmitoylhexadecasphinganine subset: chebi_ph7_3 is_a: CHEBI:144703 ! N-palmitoyl-sphingoid base is_a: CHEBI:82881 ! N-acylhexadecasphinganine [Term] id: CHEBI:82811 name: N-stearoylhexadecasphinganine subset: chebi_ph7_3 is_a: CHEBI:137568 ! Cer(d34:0) is_a: CHEBI:82881 ! N-acylhexadecasphinganine [Term] id: CHEBI:82815 name: 3-(methylthio)propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:82827 name: oleanolic aldehyde subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:50413 ! hydroxyaldehyde relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:82828 name: oleanolate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:82829 name: sphinganine-based sphingolipid subset: chebi_ph7_3 is_a: CHEBI:26739 ! sphingolipid [Term] id: CHEBI:82830 name: sphingosine-based sphingolipid subset: chebi_ph7_3 is_a: CHEBI:26739 ! sphingolipid [Term] id: CHEBI:82831 name: queuosine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:82833 name: 7-aminomethyl-7-carbaguanine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:82834 name: epoxyqueuosine 5'-phosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:82836 name: (9Z)-hexacosenoic acid is_a: CHEBI:78865 ! hexacosenoic acid [Term] id: CHEBI:82837 name: 1-oleoyl-2-palmitoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:82839 name: 1-oleoyl-2-palmitoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:82840 name: 1-oleoyl-2-myristoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:82841 name: N-octanoyldihydrosphingosine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:82842 name: N-octanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:82844 name: UDP-2-acetamido-2-deoxy-3-dehydro-alpha-D-glucopyranose is_a: CHEBI:35262 ! UDP-amino sugar [Term] id: CHEBI:82845 name: UDP-2,3-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosamine is_a: CHEBI:137952 ! UDP-2,3-diacyl-alpha-D-glucosamine [Term] id: CHEBI:82848 name: 1,2-dioleoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate) is_a: CHEBI:37393 ! 1-(3-sn-phosphatidyl)-sn-glycerol 3-phosphate [Term] id: CHEBI:82849 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1'-myo-inositol-5'-phosphate) is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:82850 name: 7-cyano-7-carbaguanine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82852 name: inosine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82869 name: (24S)-24-hydroxycholesterol ester subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester is_a: CHEBI:36865 ! 24-hydroxy steroid [Term] id: CHEBI:82875 name: (24S)-24-hydroxycholesterol 3-linoleoate subset: chebi_ph7_3 is_a: CHEBI:35915 ! sterol ester is_a: CHEBI:36865 ! 24-hydroxy steroid [Term] id: CHEBI:82881 name: N-acylhexadecasphinganine subset: chebi_ph7_3 is_a: CHEBI:139048 ! dihydroceramide [Term] id: CHEBI:82882 name: 2'-O-methylnucleotide 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82883 name: nucleotide 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82891 name: glucocorticoid receptor antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:82892 name: 1-[2-(2,4-dichlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole subset: chebi_ph7_3 is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:25698 ! ether [Term] id: CHEBI:82894 name: (R)-miconazole subset: chebi_ph7_3 is_a: CHEBI:82892 ! 1-[2-(2,4-dichlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole [Term] id: CHEBI:82897 name: (S)-miconazole subset: chebi_ph7_3 is_a: CHEBI:82892 ! 1-[2-(2,4-dichlorobenzyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole [Term] id: CHEBI:8290 name: Poly(G) is_a: CHEBI:60027 ! polymer [Term] id: CHEBI:82904 name: 2-aminophenylglyoxylate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:82918 name: hexosyl-(1<->1')-N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:23079 ! cerebroside [Term] id: CHEBI:82919 name: beta-D-glucosyl-(1<->1')-N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:82918 ! hexosyl-(1<->1')-N-acylsphinganine is_a: CHEBI:83264 ! beta-D-glucosylceramide [Term] id: CHEBI:82921 name: 1,2-dioctadecanoyl-sn-glycerol-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64861 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:82924 name: 1,2-di[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:82925 name: 1,2-di[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:82927 name: 1-palmitoyl-2-linoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82928 name: 1-palmitoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:82929 name: 1,2-dipalmitoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol is_a: CHEBI:78090 ! 1,2-dipalmitoylglycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:82930 name: 3-(3-amino-3-carboxypropyl)uridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:82939 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88057 ! ganglioside GD1(2-) [Term] id: CHEBI:82940 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) subset: chebi_ph7_3 is_a: CHEBI:79218 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82943 name: 1-palmitoyl-2-icosanoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:82945 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82947 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3'-phosphate) is_a: CHEBI:17283 ! 1-phosphatidyl-1D-myo-inositol 3-phosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:82948 name: 1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate) is_a: CHEBI:26034 ! phosphatidylinositol 3-phosphate [Term] id: CHEBI:82949 name: 1-palmitoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:82950 name: N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-glycoloylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82951 name: alpha-N-glycoloylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:82953 name: 1-(3-O-sulfonato-beta-D-galactosyl)ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:82954 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'D-myo-inositol-3',5'-bisphosphate) is_a: CHEBI:16851 ! 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate [Term] id: CHEBI:82957 name: 3-hydroxyisovalerate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:82959 name: N-hexanoylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:82961 name: 17beta-estradiol 17-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:136637 ! steroid glucosiduronic acid anion is_a: CHEBI:167107 ! estrane conjugate is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:83411 ! beta-D-glucosiduronate [Term] id: CHEBI:82963 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'D-myo-inositol-3'-phosphate) is_a: CHEBI:17283 ! 1-phosphatidyl-1D-myo-inositol 3-phosphate is_a: CHEBI:82948 ! 1,2-dipalmitoylglycero-3-phospho-(1'-D-myo-inositol-3'-phosphate) [Term] id: CHEBI:82967 name: (11Z)-3-oxohexadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:82970 name: dihydromonacolin L acid is_a: CHEBI:138397 ! octahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite [Term] id: CHEBI:82971 name: monacolin J acid is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35868 ! hydroxy monocarboxylic acid relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:82972 name: 3alpha-hydroxy-3,5-dihydromonacolin L acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:8298 name: poly[(R)-3-hydroxybutanoate] subset: chebi_ph7_3 is_a: CHEBI:167457 ! poly[(R)-3-hydroxyalkanoate] is_a: CHEBI:60160 ! polyester polymer [Term] id: CHEBI:82982 name: glycodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:82983 name: 1-oleoyl-2-acyl-sn-3-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol [Term] id: CHEBI:82985 name: mevinolinic acid is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:82987 name: monacolin L acid is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:26188 ! polyketide is_a: CHEBI:35972 ! dihydroxy monocarboxylic acid relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:83027 name: 16beta-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:17354 ! 16beta-hydroxy steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:50113 ! androgen relationship: has_role CHEBI:83056 ! Daphnia magna metabolite [Term] id: CHEBI:83032 name: 4-O-beta-D-glucosyl-trans-4-coumaric acid is_a: CHEBI:17335 ! 4-O-beta-D-glucosyl-4-coumaric acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:83038 name: Daphnia galeata metabolite is_a: CHEBI:83057 ! Daphnia metabolite [Term] id: CHEBI:83039 name: crustacean metabolite is_a: CHEBI:75767 ! animal metabolite [Term] id: CHEBI:83042 name: undecenoate is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:83043 name: 4,4'-diapolycopenedioic acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83045 name: dodecenoate is_a: CHEBI:59203 ! straight-chain fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:83047 name: 1-stearoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:29017 ! 1-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64576 ! lysophosphatidylethanolamine 18:0 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:83048 name: 4,4'-diaponeurosporenoic acid is_a: CHEBI:36783 ! apo carotenoid triterpenoid is_a: CHEBI:78840 ! olefinic compound is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83054 name: 1-stearoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:28914 ! 1-acyl-sn-glycero-3-phospho-D-myo-inositol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:83056 name: Daphnia magna metabolite is_a: CHEBI:83057 ! Daphnia metabolite [Term] id: CHEBI:83057 name: Daphnia metabolite is_a: CHEBI:83039 ! crustacean metabolite [Term] id: CHEBI:83062 name: 3'-end ribonucleotide 3'-phosphate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83064 name: 3'-end ribonucleotide 2',3'-cyclic phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83069 name: tRNA 3'-terminal nucleotidyl-cytidyl-cytidine(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83071 name: tRNA 3'-terminal nucleotidyl-cytidyl-cytidyl-adenosine(4-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83072 name: EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor is_a: CHEBI:77102 ! EC 1.3.5.* (oxidoreductase acting on CH-CH of donor with a quinone or related compound as acceptor) inhibitor [Term] id: CHEBI:83074 name: kairomone is_a: CHEBI:26645 ! semiochemical [Term] id: CHEBI:83088 name: (R)-lipoate subset: chebi_ph7_3 is_a: CHEBI:30313 ! lipoate relationship: has_role CHEBI:23357 ! cofactor [Term] id: CHEBI:83091 name: (R)-lipoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58923 ! lipoyl-AMP(1-) [Term] id: CHEBI:83093 name: (R)-dihydrolipoate subset: chebi_ph7_3 is_a: CHEBI:30316 ! dihydrolipoate [Term] id: CHEBI:83094 name: (R)-lipoamide subset: chebi_ph7_3 is_a: CHEBI:17460 ! lipoamide [Term] id: CHEBI:83096 name: (R)-S(6)-acetyldihydrolipoamide subset: chebi_ph7_3 is_a: CHEBI:16807 ! S(6)-acetyldihydrolipoamide [Term] id: CHEBI:83099 name: N(6)-[(R)-lipoyl]-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:14919 ! N(6)-lipoyl-L-lysine residue [Term] id: CHEBI:83100 name: N(6)-[(R)-dihydrolipoyl]-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:50746 ! N(6)-dihydrolipoyl-L-lysine residue [Term] id: CHEBI:83103 name: N(6)-[(R)-S(8)-aminomethyldihydrolipoyl]-L-lysine residue is_a: CHEBI:14949 ! N(6)-(S(8)-aminomethyldihydrolipoyl)-L-lysine residue [Term] id: CHEBI:83111 name: N(6)-[(R)-S(8)-acetyldihydrolipoyl]-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:78815 ! N(6)-(S(8)-acetyldihydrolipoyl)-L-lysine residue [Term] id: CHEBI:83120 name: N(6)-[(R)-S(8)-succinyldihydrolipoyl]-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:83139 name: long-chain fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:83142 name: N(6)-[(R)-S(8)-isobutyryldihydrolipoyl]-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83143 name: N(6)-[(R)-S(8)-ammoniomethyldihydrolipoyl]-L-lysine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:83144 name: biotinyl-L-lysine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83145 name: carboxybiotinyl-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83146 name: Daphnia tenebrosa metabolite is_a: CHEBI:83057 ! Daphnia metabolite [Term] id: CHEBI:83147 name: 15alpha-hydroxy steroid is_a: CHEBI:38089 ! 15-hydroxy steroid [Term] id: CHEBI:83148 name: glycino(1-) group subset: chebi_ph7_3 is_a: CHEBI:143819 ! C-terminal amino acid residue(1-) is_a: CHEBI:90782 ! C-terminal proteinogenic amino-acid residue(1-) [Term] id: CHEBI:83169 name: N-acyl homoserine lactone subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:29347 ! monocarboxylic acid amide relationship: has_role CHEBI:71338 ! autoinducer [Term] id: CHEBI:83170 name: (3R)-3-amino-3-phenylpropanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:83171 name: (2E,4Z)-2-hydroxy-7-methyl-6-oxo-2,4-octadienoic acid is_a: CHEBI:35960 ! 6-oxo monocarboxylic acid is_a: CHEBI:49302 ! 2-hydroxy monocarboxylic acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:83172 name: N-tetracosenoylsphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17636 ! sphingomyelin d18:1 [Term] id: CHEBI:83189 name: phosphatidylinositol monophosphate(3-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:83191 name: phosphatidylinositol bisphosphate(5-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:83193 name: phosphatidylinositol trisphosphate(7-) is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:83195 name: glycerophosphoglycerophosphate anion is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:83203 name: 1-stearoylglycerone 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57534 ! 1-acylglycerone 3-phosphate(2-) [Term] id: CHEBI:83211 name: tirucallane triterpenoid is_a: CHEBI:26893 ! tetracyclic triterpenoid [Term] id: CHEBI:83223 name: L-erythro-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:26739 ! sphingolipid [Term] id: CHEBI:83224 name: beta-D-glucosyl-L-erythro-N-acylsphingosine subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside [Term] id: CHEBI:83226 name: N(omega)-phospho-L-arginine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:83228 name: L-alpha-amino acid residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:83229 name: amino acid opine is_a: CHEBI:82803 ! opine is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:83233 name: Mo(=O)(=S)-molybdopterin cofactor is_a: CHEBI:21437 ! Mo-molybdopterin cofactor [Term] id: CHEBI:83234 name: beta-D-galactosyl-(1<->1')-sphinganine(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:83235 name: beta-D-galactosyl-(1<->1')-sphinganine is_a: CHEBI:36527 ! glycosylsphingoid [Term] id: CHEBI:83236 name: 2-acylglycerophospho-(2'-acylglycerol)(1-) subset: chebi_ph7_3 is_a: CHEBI:83237 ! acylglycerophosphoacylglycerol(1-) [Term] id: CHEBI:83237 name: acylglycerophosphoacylglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:83239 name: 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate) is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:83240 name: 1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol) is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol is_a: CHEBI:50477 ! butyrate ester [Term] id: CHEBI:83241 name: 1D-myo-inositol 3,4-biphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:83242 name: 1D-myo-inositol 1,3-biphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:83243 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1D-myo-inositol 3,4,5-triphosphate)(7-) subset: chebi_ph7_3 is_a: CHEBI:57836 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate(7-) [Term] id: CHEBI:83244 name: N-(2-hydroxyhexanoyl)sphingosine subset: chebi_ph7_3 is_a: CHEBI:16456 ! 2-(2-hydroxyacyl)sphingosine [Term] id: CHEBI:83245 name: N-(2-hydroxyacyl)-beta-D-galactosylsphingosine subset: chebi_ph7_3 is_a: CHEBI:18390 ! N-acyl-beta-D-galactosylsphingosine [Term] id: CHEBI:83246 name: N-(2-hydroxyhexanoyl)-beta-D-galactosylsphingosine subset: chebi_ph7_3 is_a: CHEBI:83245 ! N-(2-hydroxyacyl)-beta-D-galactosylsphingosine [Term] id: CHEBI:83247 name: N-(2-hydroxyacyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:83248 name: N-(2-hydroxyhexanoyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:83249 name: N-(2-hydroxyacyl)-beta-D-galactosylsphinganine subset: chebi_ph7_3 is_a: CHEBI:36498 ! galactosylceramide [Term] id: CHEBI:83257 name: N-(2-hydroxyhexanoyl)-beta-D-galactosylsphinganine subset: chebi_ph7_3 is_a: CHEBI:83249 ! N-(2-hydroxyacyl)-beta-D-galactosylsphinganine [Term] id: CHEBI:83262 name: alkyl,acyl-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:166904 ! glycosyldiradylglycerol is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:83264 name: beta-D-glucosylceramide subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:36500 ! glucosylceramide [Term] id: CHEBI:83273 name: N-acylsphingoid subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:83274 name: juvenile hormone III carboxylate subset: chebi_ph7_3 is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:83276 name: (2E,6E)-farnesoate subset: chebi_ph7_3 is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:83280 name: flavone C-glycoside is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:24043 ! flavones [Term] id: CHEBI:83290 name: N(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:83308 name: dioleoylphosphatidate(2-) subset: chebi_ph7_3 is_a: CHEBI:57739 ! phosphatidate(2-) [Term] id: CHEBI:83317 name: sterol biosynthesis inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:83324 name: pent-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:60015 ! 2,3-dehydroacyl-CoA(4-) [Term] id: CHEBI:83334 name: 12-HPE(8,10,14)TrE(1-) subset: chebi_ph7_3 is_a: CHEBI:131875 ! hydroperoxyicosatrienoate is_a: CHEBI:134019 ! hydroperoxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:83336 name: 14-HPDHE(1-) subset: chebi_ph7_3 is_a: CHEBI:131868 ! hydroperoxydocosahexaenoate [Term] id: CHEBI:83342 name: 10-HPO(6,8,12)TrE(1-) subset: chebi_ph7_3 is_a: CHEBI:133558 ! hydroperoxyoctadecatrienoate [Term] id: CHEBI:83343 name: 12(R)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:83344 name: 8-HPETE methyl ester subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:4986 ! fatty acid methyl ester [Term] id: CHEBI:83347 name: organosulfonic ester subset: chebi_ph7_3 is_a: CHEBI:33424 ! sulfur oxoacid derivative is_a: CHEBI:35701 ! ester [Term] id: CHEBI:83348 name: chlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:139292 ! chlorophyllide(2-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83349 name: divinyl chlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83350 name: protochlorophyllide(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83356 name: chlorophyllide b(2-) subset: chebi_ph7_3 is_a: CHEBI:139292 ! chlorophyllide(2-) is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83357 name: 7(1)-hydroxychlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83358 name: N-stearoylsphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17636 ! sphingomyelin d18:1 is_a: CHEBI:72518 ! sphingomyelin 36:1 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:83360 name: N-lignoceroylsphingosine-1-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:17636 ! sphingomyelin d18:1 is_a: CHEBI:72533 ! sphingomyelin 42:1 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:83373 name: 3-vinylbacteriochlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83374 name: all-cis-polyprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83377 name: 7(1)-hydroxychlorophyll a(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:83383 name: D-galactaro-1,5-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:83384 name: D-glucaro-1,5-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:83385 name: 2,5-diformylfuran subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:38124 ! dialdehyde [Term] id: CHEBI:83386 name: 2-(dihydroxymethyl)-5-formylfuran subset: chebi_ph7_3 is_a: CHEBI:24129 ! furans is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:63733 ! aldehyde hydrate [Term] id: CHEBI:83387 name: 5-formyl-2-furoate subset: chebi_ph7_3 is_a: CHEBI:36056 ! furancarboxylate is_a: CHEBI:71944 ! aldehydic acid anion [Term] id: CHEBI:83388 name: 5-(dihydroxymethyl)-2-furoate subset: chebi_ph7_3 is_a: CHEBI:36056 ! furancarboxylate [Term] id: CHEBI:83389 name: furan-2,5-dicarboxylate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:36056 ! furancarboxylate [Term] id: CHEBI:83390 name: pentachlorobenzenes is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:83397 name: L-citrulline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83399 name: marine xenobiotic metabolite is_a: CHEBI:76206 ! xenobiotic metabolite is_a: CHEBI:76507 ! marine metabolite [Term] id: CHEBI:83400 name: RNA polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:83401 name: anionic tRNA polymer subset: chebi_ph7_3 is_a: CHEBI:53309 ! polyanionic macromolecule [Term] id: CHEBI:83402 name: nucleoside 3',5'-bisphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83403 name: monochlorobenzenes is_a: CHEBI:23132 ! chlorobenzenes [Term] id: CHEBI:83407 name: 4-(phosphooxymethyl)-2-furancarboxaldehyde(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83408 name: sn-glycerophosphodiester(1-) subset: chebi_ph7_3 is_a: CHEBI:77847 ! glycerol 1-phosphodiester(1-) [Term] id: CHEBI:83410 name: alpha-amino acid ester(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:83411 name: beta-D-glucosiduronate subset: chebi_ph7_3 is_a: CHEBI:132367 ! beta-D-glucuronoside(1-) is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:83412 name: N(5)-acyl-L-ornithine ester(1+) subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:83414 name: alkyl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:83416 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)(7-) subset: chebi_ph7_3 is_a: CHEBI:57836 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate(7-) [Term] id: CHEBI:83417 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:57658 ! 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate(5-) [Term] id: CHEBI:83418 name: S-(5-histidyl)cysteine sulfoxide is_a: CHEBI:22063 ! sulfoxide is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83824 ! L-cysteine derivative is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:83419 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:58456 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate(5-) [Term] id: CHEBI:83420 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)(7-) subset: chebi_ph7_3 is_a: CHEBI:57836 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate(7-) [Term] id: CHEBI:83421 name: O-phospho-L-serine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:83422 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:57658 ! 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate(5-) [Term] id: CHEBI:83423 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:58456 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate(5-) [Term] id: CHEBI:83425 name: gamma-glutamyltyramine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:83431 name: [5-(ammoniomethyl)-3-furyl]methyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83433 name: 3,6-anhydro-alpha-L-galactopyranose subset: chebi_ph7_3 is_a: CHEBI:22557 ! anhydrohexose is_a: CHEBI:35990 ! bridged compound relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:83434 name: 2-hydroxy-5-methyl-1-naphthoic acid is_a: CHEBI:25392 ! naphthols is_a: CHEBI:25483 ! naphthoic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83435 name: 3,6-anhydro-L-galactonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:83436 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:58178 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) [Term] id: CHEBI:83439 name: iminoarginine(1+) subset: chebi_ph7_3 is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:83440 name: O-(S-3-oxoicosanoylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78776 ! O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1-) residue [Term] id: CHEBI:83441 name: O-[S-(3R)-hydroxyicosanoylpantetheine-4-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:78827 ! O-[S-(3R)-3-hydroxyacylpantetheine-4'-phosphoryl]serine(1-) residue [Term] id: CHEBI:83444 name: 4-(5-O-phospho-beta-D-ribofuranosyl)phenol is_a: CHEBI:20857 ! C-glycosyl compound is_a: CHEBI:35159 ! ribose monophosphate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83545 name: agmatidine 5'-phosphate(1+) residue subset: chebi_ph7_3 is_a: CHEBI:64769 ! organic cationic group [Term] id: CHEBI:83546 name: caldopentamine is_a: CHEBI:39474 ! polyazaalkane is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:50995 ! secondary amino compound relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:83547 name: N(4)-aminopropylspermidine is_a: CHEBI:39474 ! polyazaalkane is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83550 name: 1,2-ditetradecanoyl-sn-glycerol-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64863 ! 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:83553 name: N(4)-bis(aminopropyl)spermidine(1+) is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83554 name: N(4)-aminopropylspermine is_a: CHEBI:39474 ! polyazaalkane is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83561 name: N-terminal L-phenylalanyl-L-alpha-amino acid(1+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:83562 name: N-terminal L-arginyl-L-alpha-amino acid(2+) residue subset: chebi_ph7_3 is_a: CHEBI:58943 ! alpha-amino-acid cation residue [Term] id: CHEBI:83563 name: long-chain alkane subset: chebi_ph7_3 is_a: CHEBI:18310 ! alkane [Term] id: CHEBI:83564 name: (R)-3-phosphomevalonic acid is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:83565 name: (trifluoromethyl)benzenes is_a: CHEBI:22712 ! benzenes is_a: CHEBI:37143 ! organofluorine compound relationship: has_part CHEBI:50127 ! trifluoromethyl group [Term] id: CHEBI:83574 name: (R)-3,5-bisphosphomevalonic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:83575 name: monofluorobenzenes is_a: CHEBI:35496 ! fluorobenzenes [Term] id: CHEBI:83577 name: 2-carboxytetracosanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:84128 ! 2-carboxyacyl CoA(5-) [Term] id: CHEBI:83578 name: 2-carboxyhexacosanoyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:84128 ! 2-carboxyacyl CoA(5-) [Term] id: CHEBI:83579 name: 3-(methylthio)propanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:83580 name: trilinoleoyl 2-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:156311 ! trininoleoyl-monolysocardiolipin(2-) is_a: CHEBI:64743 ! 2-monolysocardiolipin(2-) [Term] id: CHEBI:83581 name: tetralinoleoyl cardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:72900 ! cardiolipin 72:8(2-) [Term] id: CHEBI:83582 name: 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:72899 ! cardiolipin 72:7(2-) [Term] id: CHEBI:83583 name: 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:72892 ! cardiolipin 70:6(2-) [Term] id: CHEBI:83585 name: N(tele)-phospho-L-histidine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83586 name: N(tele)-phosphonato-L-histidine residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:8359 name: pratensein is_a: CHEBI:133959 ! 4'-methoxyisoflavones is_a: CHEBI:55465 ! 7-hydroxyisoflavones [Term] id: CHEBI:83621 name: fatty acyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37096 ! adenosine 5'-phosphate [Term] id: CHEBI:83622 name: fatty acyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:141131 ! acyl-AMP(1-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83623 name: dodecanoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:133490 ! saturated fatty acyl-AMP(1-) is_a: CHEBI:141140 ! medium-chain fatty acyl-AMP(1-) is_a: CHEBI:83622 ! fatty acyl-AMP(1-) [Term] id: CHEBI:83624 name: O-adenyl-L-tyrosine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:83625 name: O-adenyl-L-tyrosine residue is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83626 name: tetradecanoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:133490 ! saturated fatty acyl-AMP(1-) is_a: CHEBI:136562 ! long-chain fatty acyl-AMP(1-) [Term] id: CHEBI:83627 name: hexadecanoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:133490 ! saturated fatty acyl-AMP(1-) is_a: CHEBI:136562 ! long-chain fatty acyl-AMP(1-) [Term] id: CHEBI:83628 name: N-acylammonia subset: chebi_ph7_3 is_a: CHEBI:37622 ! carboxamide [Term] id: CHEBI:83641 name: juvenile hormone I subset: chebi_ph7_3 is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:32955 ! epoxide is_a: CHEBI:4986 ! fatty acid methyl ester is_a: CHEBI:51702 ! enoate ester [Term] id: CHEBI:83661 name: lysidine monophosphate is_a: CHEBI:23524 ! cytidines is_a: CHEBI:25095 ! L-lysine derivative is_a: CHEBI:39457 ! pyrimidine ribonucleoside 5'-monophosphate is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:83662 name: lysidine monophosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83664 name: lysine monophosphate residue is_a: CHEBI:50319 ! nucleotide residue [Term] id: CHEBI:83665 name: lysidine monophosphate zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:83670 name: 9-PAHSA(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:83677 name: 12-PAHSA(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:83683 name: N-terminal N-acetyl-L-alanine residue subset: chebi_ph7_3 is_a: CHEBI:33715 ! N-terminal alpha-amino-acid residue [Term] id: CHEBI:83690 name: N-terminal N-acetyl-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:33715 ! N-terminal alpha-amino-acid residue [Term] id: CHEBI:83697 name: N(5)-alkyl-L-glutamine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:83714 name: 1,2,2'-trilinoleoyl-1'-monolysocardiolipin(2-) subset: chebi_ph7_3 is_a: CHEBI:156311 ! trininoleoyl-monolysocardiolipin(2-) is_a: CHEBI:65092 ! 1-monolysocardiolipin(2-) [Term] id: CHEBI:83716 name: 2-aminophenylglyoxylic acid is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:48975 ! substituted aniline relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:83717 name: 1,2-dipalmitoleoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66848 ! phosphatidylcholine 32:2 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:83718 name: 1,2-distearoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66858 ! phosphatidylcholine 36:0 [Term] id: CHEBI:83721 name: long-chain 3-substituted propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) [Term] id: CHEBI:83723 name: medium-chain 3-substituted propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) [Term] id: CHEBI:83724 name: very long-chain 3-substituted propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) [Term] id: CHEBI:83725 name: primary alkymercury(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:33255 ! alkylmercury compound [Term] id: CHEBI:83726 name: medium-chain 2,3-trans-enoyl CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:83727 name: long-chain 2,3-trans-enoyl CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:83728 name: very long-chain 2,3-trans-enoyl CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:83736 name: 3-[(3aS,4S,5R,7aS)-5-hydroxy-7a-methyl-1,5-dioxo-octahydroinden-4-yl]propanoate subset: chebi_ph7_3 is_a: CHEBI:157668 ! carbocyclic fatty acid anion is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:83738 name: 3-[(3aS,4S,5R,7aS)-5-hydroxy-7a-methyl-1-oxo-octahydroinden-4-yl]propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157669 ! carbocyclic fatty acyl-CoA(4-) [Term] id: CHEBI:83739 name: ferroheme c di-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83745 name: validamycins is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:26191 ! polyol relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:83746 name: 3-ketocholest-4-en-26-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:36884 ! 26-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:83757 name: EC 2.4.1.231 [alpha,alpha-trehalose phosphorylase (configuration-retaining)] inhibitor is_a: CHEBI:76789 ! EC 2.4.1.* (hexosyltransferase) inhibitor [Term] id: CHEBI:83760 name: EC 2.4.1.64 (alpha,alpha-trehalose phosphorylase) inhibitor is_a: CHEBI:76789 ! EC 2.4.1.* (hexosyltransferase) inhibitor [Term] id: CHEBI:83762 name: EC 3.2.1.28 (alpha,alpha-trehalase) inhibitor is_a: CHEBI:76789 ! EC 2.4.1.* (hexosyltransferase) inhibitor [Term] id: CHEBI:83767 name: 2''-O-acetyl-ADP-D-ribose(2-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:83774 name: 1,2-dioctadecanoyl-sn-glycerol-3-phosphate is_a: CHEBI:16337 ! phosphatidic acid is_a: CHEBI:64864 ! 1-acyl-2-octadecanoyl-sn-glycero-3-phosphate [Term] id: CHEBI:83775 name: 1,2-dioleoyl-sn-glycerol-3-phosphate is_a: CHEBI:60427 ! dioleoyl phosphatidic acid is_a: CHEBI:75109 ! 1-acyl-2-oleoyl-sn-glycero-3-phosphate [Term] id: CHEBI:83776 name: 3-oxo-23,24-bisnorchol-4-en-22-oic acid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:83777 name: 3-oxo-23,24-bisnorchol-4-en-22-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:83778 name: 1,2-di[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:83783 name: (25S)-3beta-hydroxy-5-cholesten-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:83785 name: 1-palmitoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:83792 name: 3-oxo-23,24-bisnorchol-4-en-22-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:83793 name: 3-oxo-23,24-bisnorchola-1,4-dien-22-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:83794 name: 3-hydroxy-9-oxo-9,10-seco-23,24-bisnorchola-1,3,5(10)-trien-22-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:83795 name: 3-oxodotriacontanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:143018 ! ultra-long-chain fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:83796 name: 3-hydroxy-9-oxo-9,10-seco-23,24-bisnorchola-1,3,5(10)-trien-22-oic acid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35983 ! 7-oxo monocarboxylic acid is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:47836 ! oxo seco-steroid [Term] id: CHEBI:83797 name: 3-hydroxy-9-oxo-9,10-seco-23,24-bisnorchola-1,3,5(10)-trien-22-oate subset: chebi_ph7_3 is_a: CHEBI:35984 ! 7-oxo monocarboxylic acid anion is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:83798 name: N-hexanoylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate [Term] id: CHEBI:83811 name: proteinogenic amino acid derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:83812 name: non-proteinogenic amino acid derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:83813 name: proteinogenic amino acid is_a: CHEBI:33575 ! carboxylic acid is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:83818 name: morphinane-like compound is_a: CHEBI:38101 ! organonitrogen heterocyclic compound [Term] id: CHEBI:83819 name: (25S)-3-oxocholest-4-en-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) is_a: CHEBI:57314 ! (2S)-2-methylacyl-CoA(4-) [Term] id: CHEBI:83820 name: non-proteinogenic amino acid is_a: CHEBI:33709 ! amino acid [Term] id: CHEBI:83821 name: amino acid derivative is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:83822 name: non-proteinogenic L-alpha-amino acid is_a: CHEBI:15705 ! L-alpha-amino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:83824 name: L-cysteine derivative is_a: CHEBI:23509 ! cysteine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:83828 name: DNA polyanion subset: chebi_ph7_3 is_a: CHEBI:60164 ! ionic polymer [Term] id: CHEBI:83833 name: peptidylproline (omega=0) residue subset: chebi_ph7_3 is_a: CHEBI:51422 ! organodiyl group [Term] id: CHEBI:83834 name: peptidylproline (omega=180) residue subset: chebi_ph7_3 is_a: CHEBI:51422 ! organodiyl group [Term] id: CHEBI:83836 name: UDP-beta-L-rhamnose(2-) subset: chebi_ph7_3 is_a: CHEBI:58153 ! UDP-L-rhamnose(2-) [Term] id: CHEBI:83856 name: dalpatein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:83859 name: dalnigrein(1-) subset: chebi_ph7_3 is_a: CHEBI:60038 ! flavonoid oxoanion [Term] id: CHEBI:8386 name: pregnane subset: chebi_ph7_3 is_a: CHEBI:35508 ! steroid fundamental parent [Term] id: CHEBI:83860 name: (25S)-26-hydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:63640 ! 26-hydroxycholest-4-en-3-one [Term] id: CHEBI:83861 name: (25R)-26-hydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:63640 ! 26-hydroxycholest-4-en-3-one [Term] id: CHEBI:83862 name: (25R)-3-ketocholest-4-en-26-al subset: chebi_ph7_3 is_a: CHEBI:83746 ! 3-ketocholest-4-en-26-al [Term] id: CHEBI:83863 name: (25S)-3-ketocholest-4-en-26-al subset: chebi_ph7_3 is_a: CHEBI:83746 ! 3-ketocholest-4-en-26-al [Term] id: CHEBI:83864 name: (R)-lipoyl-AMP is_a: CHEBI:55451 ! lipoyl-AMP [Term] id: CHEBI:83865 name: androst-5-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47907 ! 3-oxo-Delta(5)-steroid is_a: CHEBI:50402 ! androstanoid [Term] id: CHEBI:83866 name: N-acyl-D-galactosylsphingosine subset: chebi_ph7_3 is_a: CHEBI:36498 ! galactosylceramide is_a: CHEBI:82830 ! sphingosine-based sphingolipid [Term] id: CHEBI:83875 name: N-acyl-(3-O-sulfo-D-galactosyl)sphingosine(1-) subset: chebi_ph7_3 is_a: CHEBI:84732 ! sulfohexosyl ceramide(1-) [Term] id: CHEBI:83876 name: cationic sphingoid is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:83898 name: UDP-N-acetyl-alpha-D-muramoyl-L-alaninate(3-) subset: chebi_ph7_3 is_a: CHEBI:57953 ! UDP-N-acetylmuramoyl-L-alaninate(3-) [Term] id: CHEBI:83900 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-glutamate(4-) subset: chebi_ph7_3 is_a: CHEBI:57968 ! UDP-N-acetylmuramoyl-L-alanyl-D-glutamate(4-) [Term] id: CHEBI:83903 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl-L-lysinate(3-) subset: chebi_ph7_3 is_a: CHEBI:57736 ! UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-L-lysine(3-) [Term] id: CHEBI:83905 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioate(4-) subset: chebi_ph7_3 is_a: CHEBI:58582 ! UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioate(4-) [Term] id: CHEBI:83912 name: N(6)-(UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl)-D-lysine(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:83914 name: omega-hydroxy-15-methylpalmitate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion [Term] id: CHEBI:83916 name: omega-hydroxyphytanate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion [Term] id: CHEBI:83925 name: non-proteinogenic alpha-amino acid is_a: CHEBI:33704 ! alpha-amino acid is_a: CHEBI:83820 ! non-proteinogenic amino acid [Term] id: CHEBI:83935 name: 15-hydroxypalmitic acid is_a: CHEBI:72726 ! hydroxypalmitic acid is_a: CHEBI:78954 ! (omega-1)-hydroxy fatty acid [Term] id: CHEBI:83936 name: 15-hydroxypalmitate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:83937 name: 14-hydroxypalmitic acid is_a: CHEBI:72726 ! hydroxypalmitic acid [Term] id: CHEBI:83938 name: 14-hydroxypalmitate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:83939 name: 1-acyl-2-stearoyl-sn-glycero-3-phospho-(1D-myo-inositol)(2-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:83940 is_obsolete: true replaced_by: CHEBI:65055 [Term] id: CHEBI:83941 name: N-acetyl-D-muramoyl-L-alaninate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:83942 name: N(6)-(UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl)-D-lysine is_a: CHEBI:35257 ! UDP-glycopeptide [Term] id: CHEBI:83943 name: L-alanine derivative is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:83944 name: D-alanine derivative is_a: CHEBI:22278 ! alanine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:83946 name: N-acyl-L-alanine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:83951 name: (2E,6E,10E)-omega-hydroxyfarnesol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:26199 ! polyprenol is_a: CHEBI:36757 ! farnesane sesquiterpenoid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:83952 name: (2E,6E,10E)-geranylgeranate subset: chebi_ph7_3 is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:83953 name: omega-hydroxygeranylgeraniol subset: chebi_ph7_3 is_a: CHEBI:13643 ! glycol is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:26199 ! polyprenol [Term] id: CHEBI:83955 name: 2-saturated fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:28868 ! fatty acid anion [Term] id: CHEBI:83957 name: 1-O-(1,2-saturated-alkyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:15850 ! 1-O-alkyl-sn-glycerol [Term] id: CHEBI:83958 name: (2E,6E,10E)-omega-hydroxyfarnesyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:83960 name: N(omega)-alpha-(ADP-D-ribosyl)-L-arginine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:142554 ! N(omega)-(ADP-D-ribosyl)-L-argininium(1-) residue is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:83963 name: 2-acetamido-2-deoxy-3-O-(4-deoxy-alpha-L-threo-hex-4-enopyranosyluronate)-4-O-sulfonato-D-galactopyranose(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58958 ! organosulfate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:83965 name: L-arginine derivative is_a: CHEBI:22617 ! arginine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:83966 name: D-arginine derivative is_a: CHEBI:22617 ! arginine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:83968 name: 3-methyl fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:83969 name: 3-methylpalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83968 ! 3-methyl fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:83972 name: 3-methyl fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:67013 ! methyl-branched fatty acid anion [Term] id: CHEBI:83976 name: 2-methyl fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:67013 ! methyl-branched fatty acid anion [Term] id: CHEBI:83978 name: L-aspartic acid derivative is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:83979 name: D-aspartic acid derivative is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:83980 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1D-myo-inositol 3,4,5-triphosphate) is_a: CHEBI:16618 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate [Term] id: CHEBI:83981 name: 3-hydroxyaspartic acid is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:66873 ! C4-dicarboxylic acid [Term] id: CHEBI:83982 name: L-glutamic acid derivative is_a: CHEBI:24315 ! glutamic acid derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:83983 name: D-glutamic acid derivative is_a: CHEBI:24315 ! glutamic acid derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:83985 name: N(2)-acylglutamine is_a: CHEBI:51569 ! N-acyl-amino acid is_a: CHEBI:70813 ! glutamine derivative [Term] id: CHEBI:83989 name: O-[S-(9Z)-hexadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:83991 name: imidothioate is_a: CHEBI:16385 ! organic sulfide is_a: CHEBI:35352 ! organonitrogen compound [Term] id: CHEBI:83992 name: beta-D-glucosylsphingosine(1+) subset: chebi_ph7_3 is_a: CHEBI:62495 ! D-glucosylsphingosine(1+) [Term] id: CHEBI:84023 name: 9(10)-EpOME(1-) subset: chebi_ph7_3 is_a: CHEBI:133586 ! epoxyoctadecenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:84024 name: 14,15-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:131865 ! EET(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:84025 name: 8,9-EET(1-) subset: chebi_ph7_3 is_a: CHEBI:131865 ! EET(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:84026 name: vernolate subset: chebi_ph7_3 is_a: CHEBI:133586 ! epoxyoctadecenoate is_a: CHEBI:190711 ! epoxy fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:84027 name: 9,10-DiHOME(1-) subset: chebi_ph7_3 is_a: CHEBI:131870 ! hydroxy monounsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:84028 name: 12,13-DiHOME(1-) subset: chebi_ph7_3 is_a: CHEBI:131870 ! hydroxy monounsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:84029 name: (5Z,8Z,11Z)-14,15-dihydroxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:84031 name: (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:133539 ! hydroxyicosatrienoate [Term] id: CHEBI:84032 name: (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:84041 name: 2-O-palmitoyl-alpha,alpha-trehalose subset: chebi_ph7_3 is_a: CHEBI:62546 ! monoacyl alpha,alpha-trehalose relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84042 name: 2,3-dipalmitoyl-alpha,alpha-trehalose subset: chebi_ph7_3 is_a: CHEBI:62547 ! polyacyl alpha,alpha-trehalose relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84046 name: pyoverdine is_a: CHEBI:25676 ! oligopeptide is_a: CHEBI:26507 ! dihydroxyquinoline relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:26672 ! siderophore relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84055 name: pentose phosphate is_a: CHEBI:33447 ! phospho sugar is_a: CHEBI:63409 ! pentose derivative [Term] id: CHEBI:84059 name: octyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84062 name: nonyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84063 name: decyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84064 name: myristyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84065 name: arachidyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester [Term] id: CHEBI:84066 name: stearyl palmitate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:64857 ! cosmetic relationship: has_role CHEBI:76498 ! coral metabolite [Term] id: CHEBI:84067 name: tetradecanal subset: chebi_ph7_3 is_a: CHEBI:17176 ! long-chain fatty aldehyde is_a: CHEBI:84587 ! 2,3-saturated fatty aldehyde relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84069 name: pentanal subset: chebi_ph7_3 is_a: CHEBI:133249 ! saturated fatty aldehyde relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:84072 name: hexadecyl elaidate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester [Term] id: CHEBI:84076 name: L-histidine derivative is_a: CHEBI:24599 ! histidine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84080 name: palmityl laurate subset: chebi_ph7_3 is_a: CHEBI:10036 ! wax ester is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:84087 name: human urinary metabolite is_a: CHEBI:77746 ! human metabolite [Term] id: CHEBI:84090 name: hydroxyretinoic glucuronide is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:84092 name: 4-(beta-D-glucopyranuronosyloxy)retinoic acid is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:84090 ! hydroxyretinoic glucuronide [Term] id: CHEBI:84095 name: 2,6-dimethylheptanoyl carnitine subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35284 ! ammonium betaine is_a: CHEBI:86493 ! C9-acylcarnitine relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:84105 name: ketoretinoic acid glucuronide is_a: CHEBI:24302 ! glucosiduronic acid is_a: CHEBI:26537 ! retinoid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:84107 name: 1-O-(4-oxoretinoyl)-beta-D-glucuronic acid is_a: CHEBI:15341 ! beta-D-glucosiduronic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:84105 ! ketoretinoic acid glucuronide [Term] id: CHEBI:84111 name: L-isoleucine derivative is_a: CHEBI:24899 ! isoleucine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84113 name: D-isoleucine derivative is_a: CHEBI:24899 ! isoleucine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84114 name: D-leucine derivative is_a: CHEBI:47003 ! leucine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84118 name: ganglioside GM3 is_a: CHEBI:15681 ! alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide is_a: CHEBI:36544 ! sialodiosylceramide [Term] id: CHEBI:84121 name: L-methionine derivative is_a: CHEBI:25230 ! methionine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84122 name: D-methionine derivative is_a: CHEBI:25230 ! methionine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84123 name: advanced glycation end-product is_a: CHEBI:63299 ! carbohydrate derivative [Term] id: CHEBI:84124 name: D-tyrosine derivative is_a: CHEBI:62761 ! tyrosine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative is_a: CHEBI:84143 ! D-phenylalanine derivative [Term] id: CHEBI:84127 name: 2-carboxyacyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:84128 name: 2-carboxyacyl CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:84129 name: L-valine derivative is_a: CHEBI:27267 ! valine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84133 name: D-serine derivative is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84135 name: L-serine derivative is_a: CHEBI:26649 ! serine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84138 name: (3R)-3,6-diammoniohexanoate(1+) subset: chebi_ph7_3 is_a: CHEBI:33703 ! amino-acid cation [Term] id: CHEBI:84139 name: myo-inositol phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:67140 ! phosphate monoester dianion is_a: CHEBI:76301 ! inositol phosphate oxoanion [Term] id: CHEBI:84140 name: myo-inositol monophosphate derivative is_a: CHEBI:25703 ! organic phosphate [Term] id: CHEBI:84141 name: 1D-myo-inositol 5-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:84139 ! myo-inositol phosphate(2-) [Term] id: CHEBI:84142 name: 1D-myo-inositol 2-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:84139 ! myo-inositol phosphate(2-) [Term] id: CHEBI:84143 name: D-phenylalanine derivative is_a: CHEBI:25985 ! phenylalanine derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84144 name: L-phenylalanine derivative is_a: CHEBI:25985 ! phenylalanine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84145 name: 3beta-hydroxycholest-5-en-26-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36884 ! 26-oxo steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84146 name: 3beta-hydroxycholest-5-en-26-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:84149 name: 4-hydroxy-6-undecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84150 name: 4-hydroxy-6-(2-oxotridecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84153 name: 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:65090 ! 1-octadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol is_a: CHEBI:90432 ! phosphatidylinositol(18:0/20:4) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84162 name: (2E,6E)-farnesoic acid is_a: CHEBI:36969 ! farnesoic acid relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:84163 name: anthocyanidin 3-O-(6-O-malonyl-beta-D-glucoside) betaine subset: chebi_ph7_3 is_a: CHEBI:51978 ! oxonium betaine [Term] id: CHEBI:84166 name: 2-methoxy-6-all-trans-polyprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:84167 name: 2-methoxy-3-methyl-6-all-trans-polyprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:84168 name: 4-hydroxy-6-pentadecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84169 name: 4-hydroxy-6-heptadecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84170 name: 4-hydroxy-6-nonadecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84171 name: 4-hydroxy-6-(2-oxoheptadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84172 name: 4-hydroxy-6-(2-oxononadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84173 name: 4-hydroxy-6-(2-oxohenicosyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:17087 ! ketone is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84174 name: 12-HPE(8,10,14)TrE is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:189832 ! hydroperoxy polyunsaturated fatty acid is_a: CHEBI:23899 ! icosanoid [Term] id: CHEBI:84175 name: 2-methylhexadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:78124 ! fatty acid anion 17:0 is_a: CHEBI:83976 ! 2-methyl fatty acid anion [Term] id: CHEBI:84176 name: 12-methyloctadecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:78892 ! fatty acid anion 19:0 [Term] id: CHEBI:84177 name: 14-HPDHE is_a: CHEBI:189831 ! hydroperoxydocosahexaenoic acid [Term] id: CHEBI:84180 name: 10-HPO(6,8,12)TrE is_a: CHEBI:134615 ! hydroperoxyoctadecatrienoic acid [Term] id: CHEBI:84181 name: 12-methyloctadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84182 name: 2-methylhexadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84183 name: 3-methylundecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:83968 ! 3-methyl fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84184 name: 3-methylundecanoate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:78119 ! fatty acid anion 12:0 is_a: CHEBI:83972 ! 3-methyl fatty acid anion [Term] id: CHEBI:84185 name: D-proline derivative is_a: CHEBI:26273 ! proline derivative is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:84186 name: L-proline derivative is_a: CHEBI:26273 ! proline derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84187 name: 2-epi-5-epi-valiolone subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84189 name: L-threonine derivative is_a: CHEBI:26987 ! threonine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative [Term] id: CHEBI:84190 name: D-galactaro-1,5-lactone is_a: CHEBI:33720 ! carbohydrate acid is_a: CHEBI:37426 ! aldarolactone relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:84191 name: D-glucaro-1,5-lactone is_a: CHEBI:17849 ! glucarolactone is_a: CHEBI:33720 ! carbohydrate acid [Term] id: CHEBI:84193 name: isomyristate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:58956 ! branched-chain saturated fatty acid anion is_a: CHEBI:67013 ! methyl-branched fatty acid anion is_a: CHEBI:78121 ! fatty acid anion 14:0 [Term] id: CHEBI:84194 name: hydroxytryptophan is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:27164 ! tryptophan derivative [Term] id: CHEBI:84195 name: isomyristoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84196 name: 3-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:84197 name: 3-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:84198 name: 3-hydroxytetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:84201 name: 12-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:131872 ! hydroxy saturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:84202 name: 12-hydroxyoctadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84203 name: 15-hydroxypentadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:84204 name: omega-hydroxy fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:84205 name: 15-hydroxypentadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84204 ! omega-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:84206 name: 5-formyl-2-furoic acid is_a: CHEBI:26643 ! aldehydic acid is_a: CHEBI:33855 ! arenecarbaldehyde is_a: CHEBI:36055 ! furoic acid [Term] id: CHEBI:84207 name: 16-hydroxyhexadecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84204 ! omega-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:84948 ! 11,12-saturated fatty acyl-CoA(4-) [Term] id: CHEBI:84208 name: selenocysteine derivative is_a: CHEBI:83821 ! amino acid derivative [Term] id: CHEBI:84209 name: L-selenocysteine derivative is_a: CHEBI:83811 ! proteinogenic amino acid derivative is_a: CHEBI:84208 ! selenocysteine derivative [Term] id: CHEBI:84211 name: 5-(dihydroxymethyl)-2-furoic acid is_a: CHEBI:36055 ! furoic acid is_a: CHEBI:63733 ! aldehyde hydrate [Term] id: CHEBI:84212 name: furan-2,5-dicarboxylic acid is_a: CHEBI:24129 ! furans is_a: CHEBI:35692 ! dicarboxylic acid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:84213 name: 4-(phosphooxymethyl)-2-furancarboxaldehyde is_a: CHEBI:24129 ! furans is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:33855 ! arenecarbaldehyde relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84214 name: 9-decenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77632 ! unsaturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84215 name: gamma-glutamyltyramine is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:35735 ! dicarboxylic acid monoamide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84217 name: [5-(aminomethyl)-3-furyl]methyl phosphate is_a: CHEBI:24129 ! furans is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84234 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71727 ! phosphatidylethanolamine 36:1 zwitterion [Term] id: CHEBI:84238 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate) is_a: CHEBI:16618 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:84240 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate) is_a: CHEBI:16152 ! 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:84241 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate) is_a: CHEBI:18348 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:84244 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate) is_a: CHEBI:16618 ! 1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate [Term] id: CHEBI:84246 name: 4-hydroxy-6-heptylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84247 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4-bisphosphate) is_a: CHEBI:16152 ! 1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate [Term] id: CHEBI:84251 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate) is_a: CHEBI:18348 ! 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate [Term] id: CHEBI:84253 name: 4-hydroxy-5-methyl-6-pentadecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84255 name: 4-hydroxy-5-methyl-6-heptadecylpyran-2-one subset: chebi_ph7_3 is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:84257 name: 3,6-anhydro-L-galactonic acid is_a: CHEBI:22557 ! anhydrohexose is_a: CHEBI:33720 ! carbohydrate acid relationship: has_role CHEBI:76507 ! marine metabolite [Term] id: CHEBI:84259 name: iminoarginine is_a: CHEBI:22617 ! arginine derivative is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:33272 ! ketimine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84263 name: 1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4-phosphate) is_a: CHEBI:17526 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate [Term] id: CHEBI:84264 name: EC 3.5.1.19 (nicotinamidase) inhibitor is_a: CHEBI:76807 ! EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor [Term] id: CHEBI:84266 name: 1,2-ditetradecanoyl-sn-glycerol-3-phosphate is_a: CHEBI:64873 ! 1-acyl-2-tetradecanoyl-sn-glycero-3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:84274 name: (E)-dodec-2-enoate subset: chebi_ph7_3 is_a: CHEBI:2580 ! unsaturated fatty acid anion is_a: CHEBI:59558 ! medium-chain fatty acid anion [Term] id: CHEBI:84276 name: methyl phenyl(piperidin-2-yl)acetate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26151 ! piperidines is_a: CHEBI:85139 ! beta-amino acid ester [Term] id: CHEBI:84291 name: organic sulfur anion is_a: CHEBI:25696 ! organic anion is_a: CHEBI:26835 ! sulfur molecular entity [Term] id: CHEBI:84299 name: 1-myristoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64381 ! 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion is_a: CHEBI:72381 ! lysophosphatidylethanolamine zwitterion 14:0 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:84300 name: 1-myristoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:71712 ! phosphatidylethanolamine 32:1 zwitterion is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:84302 name: trilinoleoyl 2-monolysocardiolipin is_a: CHEBI:60430 ! 2-monolysocardiolipin [Term] id: CHEBI:84303 name: 2-carboxytetracosanoyl-CoA is_a: CHEBI:84127 ! 2-carboxyacyl-CoA [Term] id: CHEBI:84305 name: 2-carboxyhexacosanoyl-CoA is_a: CHEBI:84127 ! 2-carboxyacyl-CoA [Term] id: CHEBI:84310 name: anticapsin zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:85011 ! EC 2.6.1.16 (glutamine--fructose-6-phosphate transaminase (isomerizing)) inhibitor [Term] id: CHEBI:84311 name: bacilysin zwitterion subset: chebi_ph7_3 is_a: CHEBI:90799 ! dipeptide zwitterion [Term] id: CHEBI:84312 name: dodecanoyl-AMP is_a: CHEBI:83621 ! fatty acyl-AMP [Term] id: CHEBI:84315 name: L-arginyl-L-alpha-amino acid(1+) subset: chebi_ph7_3 is_a: CHEBI:60194 ! peptide cation [Term] id: CHEBI:84317 name: 1-acyl-2-stearoyl-sn-glycero-3-phospho-(1D-myo-inositol) is_a: CHEBI:16749 ! 1-phosphatidyl-1D-myo-inositol [Term] id: CHEBI:84320 name: dapdiamide A zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84321 name: dapdiamide B zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84322 name: dapdiamide C zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84330 name: N(3)-fumaroyl-(S)-2,3-diaminopropanoate subset: chebi_ph7_3 is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:84331 name: N(3)-fumaramoyl-(S)-2,3-diaminopropanoic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:84335 name: 2-hydroxymyristate subset: chebi_ph7_3 is_a: CHEBI:139187 ! 2-hydroxy fatty acid anion 14:0 is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:84341 name: cholesteryl linolenate subset: chebi_ph7_3 is_a: CHEBI:132004 ! cholesteryl octadecatrienoate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84342 name: nogalaviketone(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84345 name: methyl nogalonate(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84346 name: cholesteryl all-cis-icosa-8,11,14-trienoate subset: chebi_ph7_3 is_a: CHEBI:138331 ! cholesteryl icosatrienoate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84354 name: (4R)-3,4-dihydro-4-hydroxyphenylpyruvate subset: chebi_ph7_3 is_a: CHEBI:64788 ! 3,4-dihydro-4-hydroxyphenylpyruvate [Term] id: CHEBI:84355 name: 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate subset: chebi_ph7_3 is_a: CHEBI:64789 ! 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84358 name: L-dihydroanticapsin zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:84359 name: 3-hydroxy-2,4-dioxopentyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84361 name: 5-epi-valiolone subset: chebi_ph7_3 is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84362 name: 2-epi-5-epi-valiolone 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84363 name: acarbose(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:84374 name: 3-ammonio-L-alanine(1+) is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:84387 name: (1s,4s)-prephenic acid is_a: CHEBI:16666 ! prephenic acid [Term] id: CHEBI:84398 name: tetralinoleoyl cardiolipin is_a: CHEBI:28494 ! cardiolipin [Term] id: CHEBI:84399 name: 1,1',2-trilinoleoyl-2'-oleoyl cardiolipin is_a: CHEBI:28494 ! cardiolipin [Term] id: CHEBI:84400 name: 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin is_a: CHEBI:28494 ! cardiolipin [Term] id: CHEBI:84403 name: phytoceramides subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:84404 name: ceramide 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:84410 name: sphingoid base(1+) subset: chebi_ph7_3 is_a: CHEBI:35785 ! sphingoid is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:84411 name: 3-dehydrosphingoid base(1+) subset: chebi_ph7_3 is_a: CHEBI:83876 ! cationic sphingoid [Term] id: CHEBI:84412 name: tetradecanoyl-AMP is_a: CHEBI:137376 ! long-chain fatty acyl-AMP [Term] id: CHEBI:84414 name: hexadecanoyl-AMP is_a: CHEBI:137376 ! long-chain fatty acyl-AMP [Term] id: CHEBI:84417 name: 1,2-di-palmitoleoyl-2-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17815 ! 1,2-diacyl-sn-glycerol relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84422 name: 3-demethylubiquinol subset: chebi_ph7_3 is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:84423 name: 3-demethylubiquinol-9 subset: chebi_ph7_3 is_a: CHEBI:84422 ! 3-demethylubiquinol [Term] id: CHEBI:84424 name: ubiquinol-9 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol is_a: CHEBI:26253 ! polyprenylhydroquinone relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:84425 name: 9-PAHSA is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:84426 ! FAHFA relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84426 name: FAHFA is_a: CHEBI:35366 ! fatty acid is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:84427 name: 1-heptadecanoyl-2-lauroyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:64865 ! 1-acyl-2-dodecanoyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:84428 name: 1-heptadecanoyl-2-myristoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:84429 name: 1-heptadecanoyl-2-stearoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:84430 name: 1-heptadecanoyl-2-palmitoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58608 ! 1,2-diacyl-sn-glycerol 3-phosphate(2-) [Term] id: CHEBI:84431 name: 3-demethylubiquinol-7 subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:84422 ! 3-demethylubiquinol [Term] id: CHEBI:84432 name: ubiquinol-7 subset: chebi_ph7_3 is_a: CHEBI:17976 ! ubiquinol is_a: CHEBI:26253 ! polyprenylhydroquinone [Term] id: CHEBI:84442 name: 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoic acid is_a: CHEBI:25238 ! methoxybenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:84443 name: 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:24675 ! hydroxybenzoate is_a: CHEBI:25236 ! methoxybenzoate [Term] id: CHEBI:84445 name: N-acylheptadecasphingosine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:84446 name: 3,4-dihydroxy-5-all-trans-heptaprenylbenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid [Term] id: CHEBI:84447 name: (5Z,8Z,10E,14Z)-12-hydroxyicosatetraenoic acid is_a: CHEBI:19138 ! 12-HETE relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84450 name: 3,4-dihydroxy-5-all-trans-heptaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:64694 ! 3,4-dihydroxy-5-polyprenylbenzoate [Term] id: CHEBI:84451 name: 3,4-dihydroxy-5-all-trans-octaprenylbenzoic acid is_a: CHEBI:23778 ! dihydroxybenzoic acid [Term] id: CHEBI:84452 name: 3,4-dihydroxy-5-all-trans-octaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:64694 ! 3,4-dihydroxy-5-polyprenylbenzoate [Term] id: CHEBI:84453 name: 3-methoxy-4-hydroxy-5-all-trans-heptaprenylbenzoic acid is_a: CHEBI:84442 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoic acid [Term] id: CHEBI:84454 name: 3-methoxy-4-hydroxy-5-all-trans-heptaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:84443 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate [Term] id: CHEBI:84455 name: 3-methoxy-4-hydroxy-5-all-trans-octaprenylbenzoic acid is_a: CHEBI:84442 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoic acid [Term] id: CHEBI:84456 name: 3-methoxy-4-hydroxy-5-all-trans-octaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:84443 ! 3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate [Term] id: CHEBI:84461 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:57262 ! 3-sn-phosphatidyl-L-serine(1-) [Term] id: CHEBI:84462 name: 1-heptadecanoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:64379 ! 1-acyl-sn-glycero-3-phosphoserine(1-) [Term] id: CHEBI:84465 name: acyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:84466 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1-) subset: chebi_ph7_3 is_a: CHEBI:72066 ! phosphatidylserine 36:2(1-) [Term] id: CHEBI:84467 name: 1-stearoyl-sn-glycero-3-phosphoserine(1-) subset: chebi_ph7_3 is_a: CHEBI:64379 ! 1-acyl-sn-glycero-3-phosphoserine(1-) is_a: CHEBI:72408 ! lysophosphatidylserine 18:0(1-) [Term] id: CHEBI:84468 name: 12-PAHSA is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:84426 ! FAHFA relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84470 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:72427 ! phosphatidylcholine 37:4 [Term] id: CHEBI:84472 name: 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:145394 ! 1,2-diacyl-sn-glycero-3-phosphoglycerol(1-) is_a: CHEBI:60523 ! phosphatidylglycerol(1-) [Term] id: CHEBI:84473 name: 1-alkyl-2-methyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:52575 ! alkylglycerol [Term] id: CHEBI:84475 name: 1-palmitoyl-sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:75111 ! 1-acyl-sn-glycero-3-phosphoglycerol(1-) [Term] id: CHEBI:84481 name: N,O-diacylethanolamine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:84483 name: 1-O-acyl-N-acetylsphingosine subset: chebi_ph7_3 is_a: CHEBI:76222 ! 1-O-acyl-N-acylsphingosine [Term] id: CHEBI:84489 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64612 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:84490 name: 1-heptadecanoyl-sn-glycero-3-phosphoethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64381 ! 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion [Term] id: CHEBI:84492 name: 4-hydroxy-3-all-trans-hexaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:78396 ! 4-hydroxy-3-polyprenylbenzoate [Term] id: CHEBI:84493 name: (omega-1)-ethyl fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:76619 ! omega-methyl fatty acid anion [Term] id: CHEBI:84494 name: 4-hydroxy-3-all-trans-heptaprenylbenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:84496 name: 4-hydroxy-3-all-trans-heptaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:78396 ! 4-hydroxy-3-polyprenylbenzoate [Term] id: CHEBI:84497 name: (omega-1)-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:84501 name: 4-hydroxy-3-all-trans-nonaprenylbenzoic acid is_a: CHEBI:25389 ! monohydroxybenzoic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:84502 name: 4-hydroxy-3-all-trans-nonaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:78396 ! 4-hydroxy-3-polyprenylbenzoate [Term] id: CHEBI:84503 name: 4-hydroxy-3-all-trans-decaprenylbenzoate subset: chebi_ph7_3 is_a: CHEBI:78396 ! 4-hydroxy-3-polyprenylbenzoate [Term] id: CHEBI:84509 name: 2-all-trans-heptaprenylphenol subset: chebi_ph7_3 is_a: CHEBI:1269 ! 2-polyprenylphenol [Term] id: CHEBI:84510 name: 2-all-trans-nonaprenylphenol subset: chebi_ph7_3 is_a: CHEBI:1269 ! 2-polyprenylphenol [Term] id: CHEBI:84511 name: 2-all-trans-decaprenylphenol subset: chebi_ph7_3 is_a: CHEBI:1269 ! 2-polyprenylphenol [Term] id: CHEBI:84513 name: 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine is_a: CHEBI:90434 ! phosphatidylserine(18:0/18:2) relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84515 name: sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:61933 ! glycerophosphoglycerol(1-) [Term] id: CHEBI:84516 name: 3-(all-trans-heptaprenyl)benzene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:62729 ! 3-(all-trans-polyprenyl)benzene-1,2-diol [Term] id: CHEBI:84517 name: 3-(all-trans-nonaprenyl)benzene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:62729 ! 3-(all-trans-polyprenyl)benzene-1,2-diol [Term] id: CHEBI:84518 name: 3-(all-trans-decaprenyl)benzene-1,2-diol subset: chebi_ph7_3 is_a: CHEBI:62729 ! 3-(all-trans-polyprenyl)benzene-1,2-diol [Term] id: CHEBI:84521 name: 2-methoxy-6-(all-trans-heptaprenyl)phenol subset: chebi_ph7_3 is_a: CHEBI:62731 ! 2-methoxy-6-(all-trans-polyprenyl)phenol [Term] id: CHEBI:84522 name: 2-methoxy-6-(all-trans-nonaprenyl)phenol subset: chebi_ph7_3 is_a: CHEBI:62731 ! 2-methoxy-6-(all-trans-polyprenyl)phenol [Term] id: CHEBI:84528 name: 2-methoxy-6-all-trans-heptaprenylhydroquinonel subset: chebi_ph7_3 is_a: CHEBI:84166 ! 2-methoxy-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:84529 name: 2-methoxy-6-all-trans-nonaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:84166 ! 2-methoxy-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:84530 name: 6-methoxy-3-methyl-2-all-trans-heptaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:84167 ! 2-methoxy-3-methyl-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:84531 name: 2-methoxy-3-methyl-6-all-trans-nonaprenylhydroquinone subset: chebi_ph7_3 is_a: CHEBI:24646 ! hydroquinones is_a: CHEBI:84167 ! 2-methoxy-3-methyl-6-all-trans-polyprenylhydroquinone [Term] id: CHEBI:84536 name: menaquinol-6 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84537 name: dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84539 name: 2-demethylmenaquinol-6 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:8454 name: progoitrin(1-) subset: chebi_ph7_3 is_a: CHEBI:47798 ! xi-progoitrin(1-) [Term] id: CHEBI:84540 name: dTDP-3,4-didehydro-2,6-dideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:84541 name: menaquinol-9 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84542 name: 2-demethylmenaquinol-9 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:84543 name: 1-oleoyl-2-linoleyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84544 name: menaquinol-10 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84546 name: 2-demethylmenaquinol-10 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:84547 name: menaquinol-11 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84548 name: 2-demethylmenaquinol-11 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:84550 name: menaquinol-12 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84551 name: 2-demethylmenaquinol-12 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:84552 name: menaquinol-13 subset: chebi_ph7_3 is_a: CHEBI:18151 ! menaquinol relationship: has_role CHEBI:15022 ! electron donor [Term] id: CHEBI:84553 name: 2-demethylmenaquinol-13 subset: chebi_ph7_3 is_a: CHEBI:55437 ! 2-demethylmenaquinol [Term] id: CHEBI:84554 name: 3,5-dihydroxyphenylacetyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:84559 name: 2,4-dinitroanisole subset: chebi_ph7_3 is_a: CHEBI:84580 ! dinitroanisoles relationship: has_role CHEBI:63490 ! explosive [Term] id: CHEBI:84561 name: 2,4-dinitrophenol(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:84571 name: rifamycin SV(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84572 name: 27-O-demethylrifamycin SV(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84576 name: (25S)-3beta-hydroxy-5-cholesten-26-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:84579 name: 3-[(3aS,4S,5R,7aS)-5-hydroxy-7a-methyl-1-oxo-octahydroinden-4-yl]propanoic acid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:36785 ! carbobicyclic compound is_a: CHEBI:37125 ! 5-hydroxy monocarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84580 name: dinitroanisoles is_a: CHEBI:48726 ! nitroanisoles [Term] id: CHEBI:84581 name: 1,2,2'-trilinoleoyl-,1'-monolysocardiolipin is_a: CHEBI:65106 ! 1-monolysocardiolipin [Term] id: CHEBI:84584 name: 3-oxodotriacontanoyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84587 name: 2,3-saturated fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde [Term] id: CHEBI:84588 name: trans-2,3-unsaturated fatty aldehyde subset: chebi_ph7_3 is_a: CHEBI:35746 ! fatty aldehyde is_a: CHEBI:51688 ! enal [Term] id: CHEBI:84589 name: mitomycin A(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:84590 name: mitomycin B(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:84591 name: 7-demethylmitomycin B(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:84592 name: 7-demethylmitomycin A(1-) is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:84599 name: all-trans-dodecaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84600 name: all-trans-tridecaprenyl diphosphate is_a: CHEBI:55337 ! all-trans-polyprenyl diphosphate [Term] id: CHEBI:84601 name: 3-[(3aS,4S,5R,7aS)-5-hydroxy-7a-methyl-1-oxo-octahydroinden-4-yl]propanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:84602 name: all-trans-dodecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84603 name: all-trans-tridecaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58914 ! all-trans-polyprenyl diphosphate(3-) [Term] id: CHEBI:84616 name: 3-oxo-23,24-bisnorchol-4-en-22-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:84617 name: 3-oxo-23,24-bisnorchola-1,4-dien-22-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:84618 name: 3-hydroxy-9-oxo-9,10-seco-23,24-bisnorchola-1,3,5(10)-trien-22-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:84634 name: O-tetradecanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:73061 ! O-tetradecanoylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84644 name: O-octadecanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84645 name: (R)-icosanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84647 name: O-[(9Z)-tetradecenoyl]-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:85449 ! O-tetradecenoyl-L-carnitine [Term] id: CHEBI:84649 name: O-[(5Z)-tetradecenoyl]-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:85449 ! O-tetradecenoyl-L-carnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84650 name: (5Z)-tetradecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84651 name: (R)-oleoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133446 ! monounsaturated fatty acyl-L-carnitine relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:85424 ! glycine transporter 2 inhibitor [Term] id: CHEBI:84654 name: (R)-4,8-dimethylnonanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133447 ! methyl-branched fatty acyl-L-carnitine [Term] id: CHEBI:84656 name: alpha-Neu5Ac-(2->3)-beta-D-Gal(1->3)beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer(d18:1/18:0) is_a: CHEBI:18163 ! alpha-NeuNAc-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-NeuNAc-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84665 name: triacylglycerol 50:1 subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:84666 name: (25S)-3-oxocholest-4-en-26-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:84672 name: phosphatidylethanol(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:84675 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(d18:1/18:0) is_a: CHEBI:36541 ! sialotriaosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84688 name: Fe(III)-complexed hydroxamate siderophore is_a: CHEBI:28163 ! iron(III) hydroxamate is_a: CHEBI:84734 ! Fe(III)-complexed siderophore [Term] id: CHEBI:84725 name: UDP-beta-L-rhamnose is_a: CHEBI:17454 ! UDP-L-rhamnose [Term] id: CHEBI:84726 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanine is_a: CHEBI:16932 ! UDP-N-acetylmuramoyl-L-alanine [Term] id: CHEBI:84729 name: hydroxyindoles is_a: CHEBI:24828 ! indoles is_a: CHEBI:33822 ! organic hydroxy compound [Term] id: CHEBI:84732 name: sulfohexosyl ceramide(1-) is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:84733 name: dihexosylceramide sulfate(1-) is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:84734 name: Fe(III)-complexed siderophore is_a: CHEBI:5975 ! iron chelate [Term] id: CHEBI:84735 name: algal metabolite is_a: CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:84755 name: 2-deoxy-D-glucopyranose subset: chebi_ph7_3 is_a: CHEBI:15866 ! 2-deoxy-D-glucose relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:84756 name: 2-deoxy-D-glucopyranose 6-phosphate is_a: CHEBI:61667 ! D-hexopyranose 6-phosphate [Term] id: CHEBI:84760 name: 2-deoxy-D-glucopyranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:8478 name: propanoyl phosphate is_a: CHEBI:16826 ! acyl monophosphate relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:84786 name: 1-palmitoyl-2-[(6Z,9Z,12Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64424 ! phosphatidylcholine 34:3 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84788 name: trans,trans-2,4-hexadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84789 name: 1-palmitoyl-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64424 ! phosphatidylcholine 34:3 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84790 name: trans-3-hexenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:85493 ! 4-saturated-trans-3-enoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84791 name: (3E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85493 ! 4-saturated-trans-3-enoyl-CoA(4-) [Term] id: CHEBI:84793 name: trans-dec-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:85493 ! 4-saturated-trans-3-enoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84805 name: UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioic acid is_a: CHEBI:28639 ! UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminoheptanedioic acid [Term] id: CHEBI:84813 name: 4-oxo-L-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:84815 name: 1,2-di-octadecadienoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64520 ! phosphatidylcholine 36:4 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84818 name: 1-octadecanoyl-2-octadecenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66857 ! phosphatidylcholine 36:1 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84822 name: 1-octadecanoyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64433 ! phosphatidylcholine 36:2 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84824 name: aromatic L-alpha-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:84834 name: O-hexanoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:70749 ! O-hexanoylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84836 name: 1,2-di-octadecenoyl-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64433 ! phosphatidylcholine 36:2 relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84838 name: O-isobutyryl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133445 ! saturated fatty acyl-L-carnitine is_a: CHEBI:133447 ! methyl-branched fatty acyl-L-carnitine is_a: CHEBI:73017 ! O-isobutyrylcarnitine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84839 name: 1,2-di-[(9Z)-octadecenoyl]-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84840 name: (R)-2-methylbutyrylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133447 ! methyl-branched fatty acyl-L-carnitine is_a: CHEBI:73026 ! 2-methylbutyrylcarnitine [Term] id: CHEBI:84841 name: (R)-acetoacetylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133448 ! oxo-fatty acyl-L-carnitine is_a: CHEBI:75659 ! O-acyl-L-carnitine [Term] id: CHEBI:84842 name: (R)-3-hydroxybutyrylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133449 ! hydroxy-fatty acyl-L-carnitine is_a: CHEBI:85472 ! O-hydroxybutyryl-L-carnitine [Term] id: CHEBI:84843 name: (R)-2,6-dimethylheptanoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133447 ! methyl-branched fatty acyl-L-carnitine is_a: CHEBI:84095 ! 2,6-dimethylheptanoyl carnitine [Term] id: CHEBI:84847 name: 2,6-dimethylheptanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:68458 ! multi-methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:84850 name: L-selenohomocysteine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:84854 name: 2-hydroxyheptadecanoic acid is_a: CHEBI:10283 ! 2-hydroxy fatty acid [Term] id: CHEBI:84866 name: (2S)-methylsuccinyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion [Term] id: CHEBI:84879 name: nitroxyl subset: chebi_ph7_3 is_a: CHEBI:33455 ! nitrogen oxoacid [Term] id: CHEBI:84880 name: GDP-D-mannose is_a: CHEBI:21168 ! GDP-mannose [Term] id: CHEBI:84881 name: GDP-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:84886 name: GDP-alpha-D-mannuronate subset: chebi_ph7_3 is_a: CHEBI:17466 ! GDP-D-mannuronate [Term] id: CHEBI:84897 name: nogalonate(2-) subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84898 name: (R)-crotonylcarnitine subset: chebi_ph7_3 is_a: CHEBI:133450 ! (2E)-enoyl-L-carnitine is_a: CHEBI:85480 ! O-butenoyl-L-carnitine [Term] id: CHEBI:84900 name: 12-deoxynogalonate(1-) subset: chebi_ph7_3 is_a: CHEBI:35902 ! oxo monocarboxylic acid anion [Term] id: CHEBI:84904 name: (9Z,12Z)-18-hydroxyoctadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84204 ! omega-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:84912 name: dapdiamide E zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84913 name: 3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:84921 name: 7-hydroxylaurate subset: chebi_ph7_3 is_a: CHEBI:59558 ! medium-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:84925 name: omega-hydroxyphytanic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:84932 name: ethyl hexadecanoate subset: chebi_ph7_3 is_a: CHEBI:13209 ! long-chain fatty acid ethyl ester is_a: CHEBI:25835 ! hexadecanoate ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:84933 name: N-acetyl-D-muramoyl-L-alanine is_a: CHEBI:35258 ! glyco-amino acid is_a: CHEBI:83943 ! L-alanine derivative [Term] id: CHEBI:84934 name: ethyl palmitoleate subset: chebi_ph7_3 is_a: CHEBI:13209 ! long-chain fatty acid ethyl ester [Term] id: CHEBI:84936 name: ethyl octadecanoate subset: chebi_ph7_3 is_a: CHEBI:13209 ! long-chain fatty acid ethyl ester is_a: CHEBI:75925 ! octadecanoate ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:84939 name: omega-hydroxy-15-methylpalmitic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:84940 name: ethyl oleate subset: chebi_ph7_3 is_a: CHEBI:13209 ! long-chain fatty acid ethyl ester relationship: has_role CHEBI:22153 ! acaricide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:84947 name: (11Z)-Delta(11)-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58903 ! Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:84948 name: 11,12-saturated fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:84949 name: (11E)-Delta(11)-fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58903 ! Delta(11)-fatty acyl-CoA(4-) [Term] id: CHEBI:84952 name: 7-demethylmitomycin B(2-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84955 name: 7-demethylmitomycin A(2-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:84962 name: 13-hydroxy-alpha-tocopherol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23229 ! chromanol is_a: CHEBI:33853 ! phenols relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:84963 name: 13-hydroxy-gamma-tocopherol subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:23229 ! chromanol is_a: CHEBI:33853 ! phenols [Term] id: CHEBI:84966 name: ipsdienone subset: chebi_ph7_3 is_a: CHEBI:25408 ! monoterpene ketone is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:75767 ! animal metabolite relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:84968 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1D-myo-inositol-5-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:57795 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) [Term] id: CHEBI:84969 name: cholesteryl (5Z,8Z,11Z,14Z,17Z-eicosapentaenoate) subset: chebi_ph7_3 is_a: CHEBI:132007 ! cholesteryl icosapentaenoate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:84970 name: (4R)-ipsdienol subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:64419 ! meroterpenoid is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:84971 name: (2E,6E,10E)-geranylgeranic acid is_a: CHEBI:23849 ! diterpenoid is_a: CHEBI:62499 ! methyl-branched fatty acid is_a: CHEBI:73155 ! trienoic fatty acid is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid [Term] id: CHEBI:84973 name: oleoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:78279 ! lysophosphatidate 18:1 [Term] id: CHEBI:84975 name: acarbose 7(IV)-phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:84981 name: 2-aminoadipate(2-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:33558 ! alpha-amino-acid anion [Term] id: CHEBI:84985 name: (2E,6E,10E)-omega-hydroxyfarnesyl diphosphate is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:26875 ! terpenyl phosphate is_a: CHEBI:37531 ! polyprenyl diphosphate is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:84990 name: gamma-carboxy-L-glutamate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:84992 name: 3-methylpalmitoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:84994 name: 3-(methylthio)acryloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:84995 name: 3-hydroxy-3-(methylthio)propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:84996 name: 3-oxopropanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:85005 name: anticapsin is_a: CHEBI:32955 ! epoxide is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:85011 ! EC 2.6.1.16 (glutamine--fructose-6-phosphate transaminase (isomerizing)) inhibitor [Term] id: CHEBI:85006 name: N(1),N(8)-bis(sinapoyl)-spermidine(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85007 name: N(1),N(8)-bis(coumaroyl)spermidine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85008 name: trans-4-coumaroyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57355 ! 4-coumaroyl-CoA(4-) is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:85011 name: EC 2.6.1.16 (glutamine--fructose-6-phosphate transaminase (isomerizing)) inhibitor is_a: CHEBI:76879 ! EC 2.6.1.* (transaminase) inhibitor [Term] id: CHEBI:85027 name: 2'-phospho-nucleotide 5'-phosphate(3-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85033 name: cobalt(1+) subset: chebi_ph7_3 is_a: CHEBI:23336 ! cobalt cation is_a: CHEBI:25414 ! monoatomic monocation is_a: CHEBI:60242 ! monovalent inorganic cation [Term] id: CHEBI:85035 name: methyl-Co(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:33890 ! cobalt coordination entity [Term] id: CHEBI:8504 name: prostanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:26607 ! saturated fatty acid is_a: CHEBI:35744 ! carbocyclic fatty acid [Term] id: CHEBI:85040 name: (3R)-3,6-diaminohexanoic acid is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:35987 ! diamino acid [Term] id: CHEBI:85046 name: skin lightening agent is_a: CHEBI:64857 ! cosmetic [Term] id: CHEBI:85048 name: EC 1.10.3.* (oxidoreductase acting on diphenols and related substances as donors with oxygen as acceptor) inhibitor is_a: CHEBI:76737 ! EC 1.10.* (oxidoreductase acting on diphenols and related substances as donors) inhibitor [Term] id: CHEBI:85049 name: EC 1.10.3.1 (catechol oxidase) inhibitor is_a: CHEBI:85048 ! EC 1.10.3.* (oxidoreductase acting on diphenols and related substances as donors with oxygen as acceptor) inhibitor [Term] id: CHEBI:85050 name: EC 1.10.3.2 (laccase) inhibitor is_a: CHEBI:85048 ! EC 1.10.3.* (oxidoreductase acting on diphenols and related substances as donors with oxygen as acceptor) inhibitor [Term] id: CHEBI:85051 name: EC 1.13.11.24 (quercetin 2,3-dioxygenase) inhibitor is_a: CHEBI:76837 ! EC 1.13.11.* (oxidoreductase acting on single donors and incorporating 2 O atoms) inhibitor [Term] id: CHEBI:85052 name: EC 1.4.3.3 (D-amino-acid oxidase) inhibitor is_a: CHEBI:76861 ! EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor [Term] id: CHEBI:85057 name: 2-methylhexadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:85058 name: 12-methyloctadecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:85059 name: 3-methylundecanoic acid is_a: CHEBI:39417 ! branched-chain saturated fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid is_a: CHEBI:62499 ! methyl-branched fatty acid [Term] id: CHEBI:85072 name: 15-dehydroprostaglandin A1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:85073 name: 12-methyloctadecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:85074 name: 2-methylhexadecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:85075 name: 3-methylundecanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85076 name: 1-oleoyl-2-stearoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85077 name: isomyristoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:85090 name: (3E,5Z,8Z,11Z,14Z)-icosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85110 ! (3E,5Z)-dienoyl-CoA(4-) [Term] id: CHEBI:85091 name: (2E,4E,8Z,11Z,14Z)-icosapentaenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85111 ! 6-saturated-trans,trans-2,4-dienoyl-CoA(4-) [Term] id: CHEBI:85097 name: 4-saturated trans-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:85099 name: (2E,4Z)-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:85100 name: 4,5-saturated-trans-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:85097 ! 4-saturated trans-2-enoyl-CoA(4-) [Term] id: CHEBI:85101 name: trans,trans-2,4-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:85108 name: trans-3-cis-5-octadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:85110 ! (3E,5Z)-dienoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85110 name: (3E,5Z)-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) [Term] id: CHEBI:85111 name: 6-saturated-trans,trans-2,4-dienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:85101 ! trans,trans-2,4-dienoyl-CoA(4-) [Term] id: CHEBI:85130 name: 7,8-dihydroxanthopterin subset: chebi_ph7_3 is_a: CHEBI:38797 ! dihydropterin relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85133 name: 12-(phosphonooxy)octadecanoic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:85134 name: 12-(phosphonooxy)octadecanoate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:85136 name: (9E)-12-(phosphonooxy)octadecenoic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:85137 name: (9E)-12-(phosphonooxy)octadecenoate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:85139 name: beta-amino acid ester is_a: CHEBI:46668 ! amino acid ester is_a: CHEBI:83812 ! non-proteinogenic amino acid derivative [Term] id: CHEBI:85140 name: (9Z)-12-(phosphonooxy)octadecenoic acid is_a: CHEBI:36952 ! carboxyalkyl phosphate [Term] id: CHEBI:85141 name: (9Z)-12-(phosphonooxy)octadecenoate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:85142 name: methyl nogalonate is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:37484 ! dihydroxyanthraquinone [Term] id: CHEBI:85148 name: 3-hydroxytetradecanoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:35969 ! 3-hydroxy monocarboxylic acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85150 name: (9Z)-12-hydroxyoctadec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:131870 ! hydroxy monounsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:85152 name: (9E)-12-hydroxyoctadec-9-enoate subset: chebi_ph7_3 is_a: CHEBI:131870 ! hydroxy monounsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:85165 name: prostaglandin G2 2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:145037 ! hydroperoxy fatty ester is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26343 ! prostaglandins G is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85166 name: prostaglandin H2 2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85171 name: sphingoid-1-phosphocholine(1+) subset: chebi_ph7_3 is_a: CHEBI:35267 ! quaternary ammonium ion [Term] id: CHEBI:85173 name: 11-epi-prostaglandin F2alpha(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85174 name: prostaglandin D2 ethanolamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:85175 name: 11beta-prostaglandin F2alpha ethanolamide subset: chebi_ph7_3 is_a: CHEBI:29347 ! monocarboxylic acid amide is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:85184 name: dihydroxycholanic acid is_a: CHEBI:33822 ! organic hydroxy compound is_a: CHEBI:36278 ! cholanic acids [Term] id: CHEBI:85187 name: L-iduronic acid is_a: CHEBI:24769 ! iduronic acid [Term] id: CHEBI:85189 name: O-[(9Z)-hexadecenoyl]-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:85195 name: 9,10-epoxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:133585 ! epoxyoctadecanoate [Term] id: CHEBI:85197 name: 9,10-dihydroxystearate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion [Term] id: CHEBI:85198 name: N-arachidonoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:85199 name: N-icosenoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:52639 ! N-acylsphingosine [Term] id: CHEBI:85200 name: N-icosenoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:137570 ! Cer(d38:1) is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:85201 name: N-icosenoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:85204 name: N-oleoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:85205 name: 3-hydroxytetradecanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85206 name: N-arachidonoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:85207 name: N-arachidonoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:85208 name: 12-hydroxyoctadecanoic acid is_a: CHEBI:24747 ! hydroxyoctadecanoic acid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:85209 name: 12-hydroxyoctadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85210 name: N-acetyl-D-methionine is_a: CHEBI:132958 ! N-acetylmethionine is_a: CHEBI:21501 ! N-acetyl-D-amino acid is_a: CHEBI:84122 ! D-methionine derivative [Term] id: CHEBI:85211 name: 15-hydroxypentadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85212 ! omega-hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA [Term] id: CHEBI:85212 name: omega-hydroxy fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:85213 name: 16-hydroxyhexadecanoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:85212 ! omega-hydroxy fatty acyl-CoA is_a: CHEBI:85348 ! 11,12-saturated fatty acyl-CoA relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85214 name: 9-decenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85215 name: 1-myristoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:29017 ! 1-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85216 name: N-acyllysophosphatidylethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:85217 name: N-palmitoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85219 name: N-stearoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85220 name: N-acetyl-D-methionine(1-) subset: chebi_ph7_3 is_a: CHEBI:132957 ! N-acetylmethioninate [Term] id: CHEBI:85221 name: N-icosanoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85222 name: N,1-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85223 name: N-arachidonoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85225 name: N-acyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid [Term] id: CHEBI:85226 name: N-hexadecanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85227 name: N-octadecanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85228 name: N-icosanoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85229 name: N-oleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85230 name: N-arachidonoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85231 name: 1-(9Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:73332 ! 1-alkyl-2-acyl-sn-glycero-3-phosphate(2-) [Term] id: CHEBI:85232 name: prostaglandin D2 1-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26337 ! prostaglandins D is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85234 name: human blood serum metabolite is_a: CHEBI:77746 ! human metabolite [Term] id: CHEBI:85236 name: 15-deoxy-Delta(12,14)-prostaglandin J2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion [Term] id: CHEBI:85237 name: 1-myristoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:85238 name: 15-deoxy-Delta(12,14)-prostaglandin J2-2-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:17389 ! 2-monoglyceride is_a: CHEBI:26346 ! prostaglandins J [Term] id: CHEBI:85241 name: 1-monooctanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:85250 name: N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85225 ! N-acyl-sn-glycero-3-phosphoethanolamine(1-) [Term] id: CHEBI:85252 name: N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoylethanolamine subset: chebi_ph7_3 is_a: CHEBI:134165 ! N-acylethanolamine 22:6 is_a: CHEBI:67197 ! endocannabinoid [Term] id: CHEBI:85253 name: N-(icosanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85261 name: N-dodecanoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:85262 name: N-(tetradecanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85263 name: N-(dodecanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:15897 ! N-(long-chain-acyl)ethanolamine is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85268 name: (5Z)-icosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85270 name: 1,2-dihexadecanoyl-sn-glycero-3-phosphoglycerol(1-) subset: chebi_ph7_3 is_a: CHEBI:145394 ! 1,2-diacyl-sn-glycero-3-phosphoglycerol(1-) is_a: CHEBI:60523 ! phosphatidylglycerol(1-) [Term] id: CHEBI:85271 name: (Kdo)2-lipid A 1-diphosphate(7-) (E. coli) subset: chebi_ph7_3 is_a: CHEBI:193150 ! an alpha-D-Kdo-(2->4)-alpha-D-Kdo-(2->6)-lipid A 1-diphosphate(7-) is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:62643 ! anionic phospholipid is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:85275 name: (3E)-phycocyanobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:85276 name: (3E)-phycoerythrobilin(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:59252 ! linear tetrapyrrole anion [Term] id: CHEBI:85277 name: N-arachidonoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:140532 ! N-arachidonoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine(1-) is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85278 name: 17beta-hydroxyandrostan-3-one subset: chebi_ph7_3 is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid [Term] id: CHEBI:85279 name: S-3-[(2R)-phycoerythrobilin]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85280 name: S-3-[(2R)-phycocyanobilin]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85281 name: N-(polyunsaturated fatty acyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:167098 ! N-(fatty acyl)-ethanolamine is_a: CHEBI:29348 ! fatty amide is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:85282 name: N-(monounsaturated fatty acyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:167098 ! N-(fatty acyl)-ethanolamine is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:85283 name: N-(saturated fatty acyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:167098 ! N-(fatty acyl)-ethanolamine is_a: CHEBI:52640 ! N-acylethanolamine [Term] id: CHEBI:85284 name: N-(11Z)-icosenoylsphingosine subset: chebi_ph7_3 is_a: CHEBI:85199 ! N-icosenoylsphingosine [Term] id: CHEBI:85285 name: N-(11Z)-icosenoylsphinganine subset: chebi_ph7_3 is_a: CHEBI:137570 ! Cer(d38:1) is_a: CHEBI:85200 ! N-icosenoylsphinganine [Term] id: CHEBI:85286 name: N-(11Z)-icosenoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:85201 ! N-icosenoylphytosphingosine [Term] id: CHEBI:85288 name: S-3-[(2R)-phycoviolobilin]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85291 name: N,1,2-trioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85292 name: N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85293 name: N-myristoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85294 name: N-lauroyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85295 name: N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85296 name: N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85297 name: N-caproyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85298 name: N-butyryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85299 name: N-(octadecanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:134157 ! N-acylethanolamine 18:0 [Term] id: CHEBI:85300 name: N(1),N(8)-bis(sinapoyl)-spermidine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:51751 ! enamide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85301 name: N-(decanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85302 name: N-(octanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85303 name: N-(hexanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85304 name: N-(butanoyl)ethanolamine subset: chebi_ph7_3 is_a: CHEBI:85283 ! N-(saturated fatty acyl)ethanolamine [Term] id: CHEBI:85305 name: S-3-[(2R)-phycourobilin]-L-cysteine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85306 name: D-alloisoleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59871 ! D-alpha-amino acid zwitterion [Term] id: CHEBI:85307 name: heparosan D-glucuronic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:85308 name: heparosan L-iduronic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:85311 name: poly[(1->4)-beta-D-mannuronate] subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:62196 ! polysaccharide acid oxoanion [Term] id: CHEBI:85312 name: beta-D-galacturonate subset: chebi_ph7_3 is_a: CHEBI:75525 ! D-galactopyranuronate [Term] id: CHEBI:85313 name: beta-D-glucuronate subset: chebi_ph7_3 is_a: CHEBI:58720 ! D-glucopyranuronate [Term] id: CHEBI:85316 name: (R)-ethylmalonyl-CoA(5-) subset: chebi_ph7_3 is_a: CHEBI:133241 ! omega-carboxyacyl-CoA(5-) is_a: CHEBI:177898 ! omega-carboxy-(fatty acyl)-CoA(5-) is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:85317 name: D-galactaro-1,4-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:85329 name: UDP-4-dehydro-6-deoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:57810 ! UDP-4-dehydro-6-deoxy-D-glucose(2-) [Term] id: CHEBI:85330 name: dapdiamide A is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:51751 ! enamide is_a: CHEBI:85331 ! dapdiamide [Term] id: CHEBI:85331 name: dapdiamide is_a: CHEBI:46761 ! dipeptide relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85332 name: dapdiamide B is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:51751 ! enamide is_a: CHEBI:85331 ! dapdiamide [Term] id: CHEBI:85333 name: dapdiamide C is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:51751 ! enamide is_a: CHEBI:85331 ! dapdiamide [Term] id: CHEBI:85334 name: N,1-dipalmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:62537 ! N-acylphosphatidylethanolamine(1-) [Term] id: CHEBI:85335 name: N,1-dipalmitoyl-sn-glycero-3-phosphoethanolamine(1-) subset: chebi_ph7_3 is_a: CHEBI:85216 ! N-acyllysophosphatidylethanolamine(1-) [Term] id: CHEBI:85336 name: D-glucaro-1,4-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion [Term] id: CHEBI:85337 name: dapdiamide E is_a: CHEBI:32955 ! epoxide is_a: CHEBI:85331 ! dapdiamide [Term] id: CHEBI:85338 name: L-alloisoleucine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:85339 name: O-[S-(L-alloisoleucyl)pantetheine-4'-phosphoryl]serine zwitterionic residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:85342 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,5-bisphosphate)(5-) subset: chebi_ph7_3 is_a: CHEBI:57923 ! 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5-) [Term] id: CHEBI:85344 name: (4R)-3,4-dihydro-4-hydroxyphenylpyruvic acid is_a: CHEBI:64939 ! 3,4-dihydro-4-hydroxyphenylpyruvic acid [Term] id: CHEBI:85346 name: N(3)-fumaroyl-(S)-2,3-diaminopropanoic acid is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:35735 ! dicarboxylic acid monoamide is_a: CHEBI:51751 ! enamide is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85347 name: N(3)-fumaramoyl-(S)-2,3-diaminopropanoic acid is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:51751 ! enamide is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85348 name: 11,12-saturated fatty acyl-CoA is_a: CHEBI:37554 ! fatty acyl-CoA [Term] id: CHEBI:85349 name: CDP-1-stearoyl-2-arachidonoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85350 name: CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85351 name: CDP-1,2-diarachidonoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) [Term] id: CHEBI:85352 name: CDP-1-stearoyl-2-linoleoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85353 name: CDP-1-stearoyl-2-oleoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85354 name: CDP-1-stearoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) [Term] id: CHEBI:85355 name: CDP-1,2-dilinoleoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) [Term] id: CHEBI:85356 name: CDP-1,2-dioleoyl-sn-glycerol(2-) subset: chebi_ph7_3 is_a: CHEBI:58332 ! CDP-diacylglycerol(2-) [Term] id: CHEBI:85357 name: 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid is_a: CHEBI:64942 ! 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85360 name: L-dihydroanticapsin is_a: CHEBI:32955 ! epoxide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:46733 ! oxabicycloalkane is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid is_a: CHEBI:83943 ! L-alanine derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85366 name: 3-hydroxy-2,4-dioxopentyl phosphate is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:7794 ! phosphate monoester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85367 name: 2-epi-5-epi-valiolone 7-phosphate is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:7794 ! phosphate monoester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85368 name: dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85369 name: dTDP-3,4-didehydro-2,6-dideoxy-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85375 name: N-acetylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:85376 name: N-octanoylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:85378 name: N-oleoylsphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:57674 ! N-acylsphingosine 1-phosphate(2-) [Term] id: CHEBI:85382 name: 1-heptadecanoyl-2-lauroyl-sn-glycero-3-phosphate is_a: CHEBI:64877 ! 1-acyl-2-dodecanoyl-sn-glycero-3-phosphate is_a: CHEBI:87659 ! dodecanoate ester [Term] id: CHEBI:85383 name: 1-heptadecanoyl-2-myristoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:85385 name: 1-heptadecanoyl-2-stearoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:85386 name: 1-heptadecanoyl-2-palmitoyl-sn-glycero-3-phosphate is_a: CHEBI:29089 ! 1,2-diacyl-sn-glycerol 3-phosphate [Term] id: CHEBI:85400 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphoserine is_a: CHEBI:11750 ! 3-sn-phosphatidyl-L-serine [Term] id: CHEBI:85401 name: 1-heptadecanoyl-sn-glycero-3-phosphoserine is_a: CHEBI:52603 ! 1-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:85403 name: 1-stearoyl-sn-glycero-3-phosphoserine is_a: CHEBI:52603 ! 1-acyl-sn-glycero-3-phosphoserine [Term] id: CHEBI:85404 name: 3-dehydrocarnityl CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85405 name: N,N,N-trimethylglycyl-CoA(3-) subset: chebi_ph7_3 is_a: CHEBI:58946 ! acyl-CoA oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85407 name: 1-palmitoyl-sn-glycero-3-phosphoglycerol is_a: CHEBI:62747 ! 1-acyl-sn-glycero-3-phosphoglycerol [Term] id: CHEBI:85408 name: 1-heptadecanoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:64674 ! 1,2-diacyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85409 name: 1-heptadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:138532 ! lysophosphatidylethanolamine 17:0 is_a: CHEBI:29017 ! 1-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85411 name: sn-glycero-3-phosphoglycerol is_a: CHEBI:5457 ! glycerophosphoglycerol [Term] id: CHEBI:85412 name: mitomycin A is_a: CHEBI:25357 ! mitomycin is_a: CHEBI:25698 ! ether relationship: has_role CHEBI:22333 ! alkylating agent relationship: has_role CHEBI:27026 ! toxin relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:85413 name: 5-hydroxyectoine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35285 ! iminium betaine [Term] id: CHEBI:85414 name: (6S)-5,6,7,8-tetrahydropteroate subset: chebi_ph7_3 is_a: CHEBI:38796 ! pteroates [Term] id: CHEBI:85415 name: (Z)-hex-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85416 name: mitomycin B is_a: CHEBI:25357 ! mitomycin is_a: CHEBI:25698 ! ether relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:85417 name: dTDP-beta-L-daunosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85418 name: 7-demethylmitomycin B is_a: CHEBI:25357 ! mitomycin is_a: CHEBI:73080 ! hemiaminal [Term] id: CHEBI:85419 name: 7-demethylmitomycin A is_a: CHEBI:25357 ! mitomycin is_a: CHEBI:38163 ! organic heterotetracyclic compound [Term] id: CHEBI:85420 name: N-isopropyl-L-glutamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85421 name: N-(gamma-L-glutamyl)-L-alaninol zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85422 name: (S)-2-aminopropan-1-ol(1+) subset: chebi_ph7_3 is_a: CHEBI:195439 ! 2-aminopropan-1-ol(1+) is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:85424 name: glycine transporter 2 inhibitor is_a: CHEBI:85425 ! glycine transporter inhibitor [Term] id: CHEBI:85425 name: glycine transporter inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:85426 name: 3-phenylpropionitrile subset: chebi_ph7_3 is_a: CHEBI:18379 ! nitrile is_a: CHEBI:22712 ! benzenes [Term] id: CHEBI:85427 name: 1,2-dipalmitoyl-3-palmitoleoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:64615 ! triacyl-sn-glycerol [Term] id: CHEBI:85428 name: trans-3-hydroxy-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:85429 name: phosphatidylethanol is_a: CHEBI:16648 ! dialkyl phosphate is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:85430 name: 11-deoxy-beta-rhodomycin zwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:85433 name: glutamine hydroxamate zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:85439 name: trans,trans-2,4-hexadienoyl-CoA is_a: CHEBI:17157 ! trans,trans-2,3,4,5-tetradehydroacyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85440 name: very long-chain (R)-3-hydroxyacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57319 ! (R)-3-hydroxyacyl-CoA(4-) [Term] id: CHEBI:85442 name: trans-3-hexenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27700 ! trans-3-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85443 name: (3E,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-CoA is_a: CHEBI:27700 ! trans-3-enoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:85445 name: 2'-deoxyguanosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:140284 ! deoxyribonucleotide(1-) residue [Term] id: CHEBI:85448 name: 6-O-methyl dGMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85449 name: O-tetradecenoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133446 ! monounsaturated fatty acyl-L-carnitine is_a: CHEBI:86066 ! O-tetradecenoylcarnitine [Term] id: CHEBI:85452 name: 2'-deoxycytidine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:140284 ! deoxyribonucleotide(1-) residue [Term] id: CHEBI:85454 name: 5-methyl dCMP(1-) residue subset: chebi_ph7_3 is_a: CHEBI:65262 ! pyrimidine deoxyribonucleotide(1-) residue [Term] id: CHEBI:85468 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4-phosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:58178 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) [Term] id: CHEBI:85471 name: cobalt(II)-factor IV(6-) subset: chebi_ph7_3 is_a: CHEBI:59140 ! precorrin carboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85472 name: O-hydroxybutyryl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:133449 ! hydroxy-fatty acyl-L-carnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:85474 name: 4-hydroxy-6-(2-hydroxytridecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85475 name: 4-hydroxy-6-(11-hydroxyheptadecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85477 name: 4-hydroxy-6-(15-hydroxypentadecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85479 name: 4-hydroxy-6-(non-8-en-1-yl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85480 name: O-butenoyl-L-carnitine subset: chebi_ph7_3 is_a: CHEBI:75659 ! O-acyl-L-carnitine is_a: CHEBI:86077 ! O-butenoylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:85481 name: 4-hydroxy-6-(14-hydroxytetradecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85482 name: 6-(hexadecan-2-yl)-4-hydroxy-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85483 name: 4-hydroxy-6-(2-methyldecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85484 name: 4-hydroxy-6-(11-methylheptadecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85485 name: 4-hydroxy-6-(11-methyldodecyl)-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85514 ! 6-alkyl-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85488 name: chloroeremomycin(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:85489 name: cis-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:85490 name: 4-hydroxy-6-(13-hydroxy-2-oxononadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85491 name: epivancomycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:85492 name: 4-hydroxy-6-(17-hydroxy-2-oxoheptadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85493 name: 4-saturated-trans-3-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) [Term] id: CHEBI:85494 name: 4-hydroxy-6-(2-oxoundec-10-en-1-yl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85495 name: 4-hydroxy-6-(16-hydroxy-2-oxohexadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85496 name: 4-hydroxy-6-(3-methyl-2-oxoheptadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85497 name: 4-hydroxy-6-(4-methyl-2-oxododecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85498 name: 4-hydroxy-6-(13-methyl-2-oxononadecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85499 name: 4-hydroxy-6-(13-methyl-2-oxotetradecyl)pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:85511 ! 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one [Term] id: CHEBI:85501 name: N(4)-(beta-D-glucosyl)-L-asparagine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:85504 name: 2,6-dimethylheptanoyl-CoA is_a: CHEBI:18100 ! multi-methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85507 name: GDP-alpha-D-mannuronic acid is_a: CHEBI:21161 ! GDP-D-mannuronic acid [Term] id: CHEBI:85508 name: (9Z,12Z)-18-hydroxyoctadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85212 ! omega-hydroxy fatty acyl-CoA [Term] id: CHEBI:85509 name: 3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine is_a: CHEBI:32955 ! epoxide is_a: CHEBI:33706 ! beta-amino acid is_a: CHEBI:35779 ! dicarboxylic acid diamide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85510 name: 7-hydroxylauric acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:59554 ! medium-chain fatty acid [Term] id: CHEBI:85511 name: 6-(acylmethyl)-4-hydroxy-2H-pyran-2-one is_a: CHEBI:17087 ! ketone is_a: CHEBI:26188 ! polyketide is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:85512 name: 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+) is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:85514 name: 6-alkyl-4-hydroxy-2H-pyran-2-one subset: chebi_ph7_3 is_a: CHEBI:26188 ! polyketide is_a: CHEBI:74818 ! heteroaryl hydroxy compound is_a: CHEBI:75885 ! 2-pyranones [Term] id: CHEBI:85517 name: acarbose 7(IV)-phosphate is_a: CHEBI:16916 ! oligosaccharide phosphate is_a: CHEBI:63567 ! tetrasaccharide derivative [Term] id: CHEBI:85521 name: 1,2-dipalmitoyl-sn-glycero-3-phospho-(1D-myo-inositol-5-phosphate) is_a: CHEBI:16500 ! 1-phosphatidyl-1D-myo-inositol 5-phosphate [Term] id: CHEBI:85524 name: (3E,5Z,8Z,11Z,14Z)-icosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:85528 name: 3-(methylthio)acryloyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:85529 name: 3-hydroxy-3-(methylthio)propanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:85530 name: N(1),N(8)-bis(coumaroyl)spermidine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:51751 ! enamide relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85531 name: trans-4-coumaroyl-CoA is_a: CHEBI:15499 ! 4-coumaroyl-CoA [Term] id: CHEBI:85532 name: D-galactaro-1,4-lactone is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:37426 ! aldarolactone [Term] id: CHEBI:85533 name: trans-4-hydroxy-L-proline betaine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:26456 ! pyrrolidine alkaloid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85534 name: cis-4-hydroxy-D-proline betaine subset: chebi_ph7_3 is_a: CHEBI:22860 ! amino-acid betaine is_a: CHEBI:26456 ! pyrrolidine alkaloid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:85538 name: (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate subset: chebi_ph7_3 is_a: CHEBI:58109 ! (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85541 name: elemental bismuth is_a: CHEBI:33259 ! elemental molecular entity is_a: CHEBI:37196 ! bismuth molecular entity [Term] id: CHEBI:85543 name: bismuth ion is_a: CHEBI:36914 ! inorganic ion is_a: CHEBI:85541 ! elemental bismuth [Term] id: CHEBI:85547 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchola-1,4-dien-22-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:85548 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:85549 name: 9alpha-hydroxyandrost-4-en-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:63644 ! 9-hydroxy steroid [Term] id: CHEBI:85550 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:85551 name: 3-oxo-23,24-bisnorchola-1,4-dien-22-oate(1-) subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:85552 name: 15-dehydroprostaglandin A1 is_a: CHEBI:26334 ! prostaglandins A relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85553 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchola-1,4-dien-22-oate(1-) subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:85554 name: (2E,4E,8Z,11Z,14Z)-icosapentaenoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:85555 name: (2E,4Z)-dienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:85556 name: trans,trans-2,4-dienoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:85557 name: trans-3-cis-5-octadienoyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA is_a: CHEBI:85559 ! (3E,5Z)-dienoyl-CoA [Term] id: CHEBI:85559 name: (3E,5Z)-dienoyl-CoA is_a: CHEBI:27700 ! trans-3-enoyl-CoA [Term] id: CHEBI:85560 name: (5Z)-icosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:85563 name: lysophosphatidylcholine 6:0 subset: chebi_ph7_3 is_a: CHEBI:60479 ! lysophosphatidylcholine [Term] id: CHEBI:85564 name: phosphatidylcholine 24:0 subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:85575 name: 3,17-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9-one subset: chebi_ph7_3 is_a: CHEBI:24751 ! hydroxytoluene is_a: CHEBI:26616 ! seco-androstane is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85576 name: 3,4,17-trihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9-one subset: chebi_ph7_3 is_a: CHEBI:26616 ! seco-androstane is_a: CHEBI:33566 ! catechols is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85586 name: glutathione S-sulfinate(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:85587 name: 9-hydroperoxy-10E-octadecenoic acid is_a: CHEBI:134613 ! hydroperoxyoctadecenoic acid [Term] id: CHEBI:85589 name: 10-hydroperoxy-8E-octadecenoic acid is_a: CHEBI:134613 ! hydroperoxyoctadecenoic acid [Term] id: CHEBI:85602 name: N-carbamoyl-D-alpha-amino acid anion subset: chebi_ph7_3 is_a: CHEBI:59876 ! N-acyl-D-alpha-amino acid anion [Term] id: CHEBI:85603 name: 1-tuberculosinyladenosine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85614 name: neopikromycin is_a: CHEBI:25105 ! macrolide antibiotic is_a: CHEBI:26188 ! polyketide is_a: CHEBI:51689 ! enone is_a: CHEBI:63367 ! monosaccharide derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85616 name: viridicatumtoxin is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:140324 ! primary carboxamide is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:33823 ! enol is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:51751 ! enamide is_a: CHEBI:51958 ! organic polycyclic compound is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:85618 ! EC 2.5.1.31 {ditrans,polycis-undecaprenyl-diphosphate synthase [(2E,6E)-farnesyl-diphosphate specific]} inhibitor [Term] id: CHEBI:85618 name: EC 2.5.1.31 \{ditrans,polycis-undecaprenyl-diphosphate synthase [(2E,6E)-farnesyl-diphosphate specific]} inhibitor is_a: CHEBI:76663 ! EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor [Term] id: CHEBI:85620 name: Fe4S3 iron-sulfur cluster is_a: CHEBI:30408 ! iron-sulfur cluster [Term] id: CHEBI:85621 name: L-3-oxoalanine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:85630 name: (Kdo)2-lipid A 1-diphosphate (E. coli) is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:85634 name: (3R)-3-hydroxy fatty acid anion subset: chebi_ph7_3 is_a: CHEBI:84196 ! 3-hydroxy fatty acid anion [Term] id: CHEBI:85635 name: (R)-3-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:85634 ! (3R)-3-hydroxy fatty acid anion [Term] id: CHEBI:85636 name: (2R)-2-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:76177 ! (2R)-2-hydroxy fatty acid anion is_a: CHEBI:84335 ! 2-hydroxymyristate [Term] id: CHEBI:85637 name: (2S)-2-hydroxytetradecanoate subset: chebi_ph7_3 is_a: CHEBI:58123 ! (2S)-2-hydroxy monocarboxylic acid anion is_a: CHEBI:84335 ! 2-hydroxymyristate [Term] id: CHEBI:85638 name: haloacetate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:85639 name: (9Z)-12-hydroxyoctadec-9-enoic acid is_a: CHEBI:131869 ! hydroxy monounsaturated fatty acid is_a: CHEBI:134362 ! homoallylic alcohol is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid is_a: CHEBI:35681 ! secondary alcohol [Term] id: CHEBI:85640 name: cis-3-octenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:85489 ! cis-3-enoyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85641 name: (9E)-12-hydroxyoctadec-9-enoic acid is_a: CHEBI:131869 ! hydroxy monounsaturated fatty acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:85643 name: 3'-terminal pUpU(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85644 name: UMP 2',3'-cyclic phosphate(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85650 name: (11E,13Z)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) [Term] id: CHEBI:85651 name: (5Z,11E)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) [Term] id: CHEBI:85652 name: (6Z,11E)-octadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139565 ! octadecadienoyl-CoA(4-) [Term] id: CHEBI:85654 name: N-palmitoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85655 name: (3E)-nonenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85656 name: N-acyllysophosphatidylethanolamine is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:85657 name: N-hexadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85658 name: N-acyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:37739 ! glycerophospholipid [Term] id: CHEBI:85659 name: (3E)-phycoerythrobilin is_a: CHEBI:36741 ! phycoerythrobilin [Term] id: CHEBI:85660 name: N-stearoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85661 name: 9,10-epoxyoctadecanoic acid is_a: CHEBI:134617 ! epoxystearic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85664 name: N,1-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85666 name: N-arachidonoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85667 name: N-icosanoyl-1-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85668 name: N-octadecanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85669 name: N-icosanoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85670 name: N-oleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85671 name: N-arachidonoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85672 name: 1-(9Z-octadecenyl)-2-arachidonoyl-sn-glycero-3-phosphate is_a: CHEBI:37296 ! 1-alkyl-2-acyl-sn-glycerol 3-phosphate [Term] id: CHEBI:85674 name: 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oate(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:85675 name: 3-phenylpropanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:85676 name: 3-phenylpropanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:85678 name: (3R)-3-hydroxy fatty acid is_a: CHEBI:59845 ! 3-hydroxy fatty acid [Term] id: CHEBI:85679 name: 1,2-dioleoyl-sn-glycero-3-phospho-N-methylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64573 ! 1,2-diacyl-sn-glycero-3-phospho-N-methylethanolamine zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85680 name: 1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion subset: chebi_ph7_3 is_a: CHEBI:64572 ! 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85687 name: diacylglycerol 32:1 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:85688 name: diacylglycerol 32:0 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:85694 name: diacylglycerol 34:1 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:857 name: 2,2'-iminodipropanoic acid is_a: CHEBI:36164 ! amino dicarboxylic acid is_a: CHEBI:83229 ! amino acid opine [Term] id: CHEBI:85701 name: diacylglycerol 36:2 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:85721 name: diacylglycerol 28:0 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:85777 name: Cer(d42:1) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:85778 name: 4beta-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:23824 ! diol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85779 name: 4beta,7alpha-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:27136 ! triol is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:53030 ! oxysterol is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:85780 name: N-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85658 ! N-acyl-sn-glycero-3-phosphoethanolamine [Term] id: CHEBI:85783 name: 1,2-dihexadecanoyl-sn-glycero-3-phosphoglycerol is_a: CHEBI:60724 ! dipalmitoyl phosphatidylglycerol [Term] id: CHEBI:85784 name: N-arachidonoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85785 name: monodechloroaminopyrrolnitrin subset: chebi_ph7_3 is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85786 name: aminopyrrolnitrin subset: chebi_ph7_3 is_a: CHEBI:26455 ! pyrroles is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:35497 ! androgen antagonist relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85787 name: 1-decanoyl-2-oleoylglycerol subset: chebi_ph7_3 is_a: CHEBI:49172 ! 1,2-diglyceride [Term] id: CHEBI:85790 name: N,1,2-trioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:138239 ! N-oleoyl-1,2-diacyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85791 name: N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85793 name: N-myristoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85794 name: N-lauroyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85796 name: N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85797 name: N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85798 name: N-caproyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85799 name: N-butyryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85800 name: (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid is_a: CHEBI:17337 ! (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85801 name: heparosan D-glucuronic acid is_a: CHEBI:24500 ! heparan [Term] id: CHEBI:85802 name: heparosan L-iduronic acid is_a: CHEBI:24500 ! heparan [Term] id: CHEBI:85803 name: (R)-ethylmalonyl-CoA is_a: CHEBI:37555 ! omega-carboxyacyl-CoA [Term] id: CHEBI:85804 name: UDP-4-dehydro-6-deoxy-alpha-D-glucose is_a: CHEBI:16553 ! UDP-4-dehydro-6-deoxy-D-glucose [Term] id: CHEBI:85805 name: D-glucaro-1,4-lactone is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:37426 ! aldarolactone [Term] id: CHEBI:85806 name: N,1-dipalmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:61232 ! N-acylphosphatidylethanolamine [Term] id: CHEBI:85808 name: N,1-dipalmitoyl-sn-glycero-3-phosphoethanolamine is_a: CHEBI:85656 ! N-acyllysophosphatidylethanolamine [Term] id: CHEBI:85809 name: 5alpha-androstane-3beta,6alpha,17beta-triol subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36850 ! 6alpha-hydroxy steroid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:85810 name: androst-5-ene-3beta,7alpha,17beta-triol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:27136 ! triol is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid [Term] id: CHEBI:85811 name: (6S)-5,6,7,8-tetrahydropteroic acid is_a: CHEBI:38795 ! pteroic acids [Term] id: CHEBI:85812 name: Cer(d42:2) subset: chebi_ph7_3 is_a: CHEBI:83273 ! N-acylsphingoid [Term] id: CHEBI:85816 name: (3beta,5alpha,7alpha)-3,7-dihydroxyandrostan-17-one subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid [Term] id: CHEBI:85820 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,5-bisphosphate) is_a: CHEBI:16851 ! 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:85829 name: CDP-1-stearoyl-2-arachidonoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85830 name: CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85835 name: CDP-1,2-diarachidonoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol [Term] id: CHEBI:85838 name: CDP-1-stearoyl-2-linoleoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85841 name: CDP-1-stearoyl-2-oleoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85846 name: CDP-1-stearoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol [Term] id: CHEBI:85848 name: CDP-1,2-dilinoleoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol [Term] id: CHEBI:85856 name: CDP-1,2-dioleoyl-sn-glycerol is_a: CHEBI:17962 ! CDP-diacylglycerol [Term] id: CHEBI:85876 name: triacylglycerol 54:6 subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride [Term] id: CHEBI:8588 name: protodioscin subset: chebi_ph7_3 is_a: CHEBI:22798 ! beta-D-glucoside is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:59780 ! cyclic hemiketal is_a: CHEBI:61655 ! steroid saponin is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:85881 name: N-octanoylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate [Term] id: CHEBI:85882 name: N-oleoylsphingosine 1-phosphate is_a: CHEBI:16197 ! N-acylsphingosine 1-phosphate [Term] id: CHEBI:85886 name: 3-dehydrocarnityl CoA is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85888 name: N,N,N-trimethylglycyl-CoA is_a: CHEBI:17984 ! acyl-CoA is_a: CHEBI:35267 ! quaternary ammonium ion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85889 name: (Z)-hex-3-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:27773 ! cis-3-enoyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85891 name: N-isopropyl-L-glutamine is_a: CHEBI:21844 ! N(5)-alkyl-L-glutamine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85894 name: N-(gamma-L-glutamyl)-L-alaninol is_a: CHEBI:21844 ! N(5)-alkyl-L-glutamine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85895 name: 4-amino-5-formamidomethyl-2-methylpyrimidine subset: chebi_ph7_3 is_a: CHEBI:24079 ! formamides is_a: CHEBI:38338 ! aminopyrimidine relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:85897 name: 11-deoxy-beta-rhodomycin is_a: CHEBI:25830 ! p-quinones is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:35315 ! deoxy hexoside is_a: CHEBI:47779 ! aminoglycoside is_a: CHEBI:48120 ! anthracycline is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:85899 name: 4-pregnen-3beta-ol-20-one subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:61313 ! C21-steroid [Term] id: CHEBI:85900 name: 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4-phosphate) is_a: CHEBI:17526 ! 1-phosphatidyl-1D-myo-inositol 4-phosphate is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:85901 name: epivancomycin is_a: CHEBI:24396 ! glycopeptide is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:85904 name: glutathione S-sulfinate is_a: CHEBI:17021 ! S-substituted glutathione is_a: CHEBI:47923 ! tripeptide is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:85905 name: cobalt(II)-factor IV is_a: CHEBI:23389 ! cobalt-corrinoid heptacarboxylic acid is_a: CHEBI:25216 ! metalloporphyrin relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85906 name: (2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone subset: chebi_ph7_3 is_a: CHEBI:62734 ! 2,7-dihydroxy-4'-methoxyisoflavanone [Term] id: CHEBI:85907 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchola-1,4-dien-22-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:85908 name: 2-methyl-L-tryptophan zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:85909 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:85910 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oic acid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:63644 ! 9-hydroxy steroid [Term] id: CHEBI:85911 name: 3-oxo-23,24-bisnorchola-1,4-dien-22-oic acid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:77166 ! 3-oxo-Delta(1),Delta(4)-steroid [Term] id: CHEBI:85912 name: 9alpha-hydroxy-3-oxo-23,24-bisnorchola-1,4-dien-22-oic acid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:63644 ! 9-hydroxy steroid is_a: CHEBI:77166 ! 3-oxo-Delta(1),Delta(4)-steroid [Term] id: CHEBI:85914 name: (9Z,12Z)-hexadeca-9,12,15-trienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:85919 name: O-[S-(4Z)-hexadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:85926 name: (14Z)-hexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) [Term] id: CHEBI:85927 name: (14E)-hexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) [Term] id: CHEBI:85934 name: (2R)-2-hydroxytetradecanoic acid is_a: CHEBI:59270 ! 2-hydroxymyristic acid [Term] id: CHEBI:85936 name: 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:38337 ! pyrimidone is_a: CHEBI:50994 ! primary amino compound [Term] id: CHEBI:85937 name: (2S)-2-hydroxytetradecanoic acid is_a: CHEBI:17375 ! (2S)-2-hydroxy monocarboxylic acid is_a: CHEBI:59270 ! 2-hydroxymyristic acid [Term] id: CHEBI:85939 name: cis-3-octenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85951 name: N-acyl-(4R,8Z)-4-hydroxysphing-8-enine subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide [Term] id: CHEBI:85953 name: N-acyl-(4E,8E)-sphinga-4,8-dienine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:85955 name: (11E,13Z)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA [Term] id: CHEBI:85956 name: (5Z,11E)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA [Term] id: CHEBI:85957 name: (6Z,11E)-octadecadienoyl-CoA is_a: CHEBI:139578 ! octadecadienoyl-CoA [Term] id: CHEBI:85958 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-2'-O-methyladenosine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85959 name: 5'-(N(7)-methyl 5'-triphosphoguanosine)-N(6)-methyl-2'-O-methyladenosine(2-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:85960 name: (3E)-nonenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:85962 name: 1,2-dioleoyl-sn-glycero-3-phospho-N-methylethanolamine is_a: CHEBI:64596 ! 1,2-diacyl-sn-glycero-3-phospho-N-methylethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85963 name: 1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine is_a: CHEBI:64595 ! 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85970 name: hydroxyaurone is_a: CHEBI:33853 ! phenols is_a: CHEBI:72576 ! aurones [Term] id: CHEBI:85981 name: L-homocarnosine is_a: CHEBI:28050 ! homocarnosine is_a: CHEBI:46761 ! dipeptide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84076 ! L-histidine derivative relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:85985 name: 3-deoxy-alpha-D-manno-2-octulosonate-8-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:85986 name: 3-deoxy-alpha-D-manno-oct-2-ulosonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:85987 name: CMP-3-deoxy-beta-D-manno-octulosonate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:86013 name: 2-hydroxytestosterone subset: chebi_ph7_3 is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36857 ! 2-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:50402 ! androstanoid [Term] id: CHEBI:86014 name: 3,22-dioxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86016 name: GDP-N,N'-diacetylbacillosamine(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:86018 name: 3beta-hydroxychol-5-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86019 name: S-[(2E,6E)-farnesyl]-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:8602 name: pseudobaptigenin is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:55465 ! 7-hydroxyisoflavones relationship: has_role CHEBI:35820 ! antiprotozoal drug relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86020 name: 20-methyl-3-oxopregna-4,17-dien-21-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86021 name: S-geranylgeranyl-L-cysteine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:86026 name: tRNA threonylcarbamoyladenosine is_a: CHEBI:33697 ! ribonucleic acid [Term] id: CHEBI:86027 name: naphthopyran is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:38104 ! oxacycle [Term] id: CHEBI:86028 name: 17-hydroxy-3-oxopregn-4-en-20-carboxy-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86029 name: liver X receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:86037 name: 3beta-hydroxychola-5,22-dien-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86040 name: 3-hydroxyoctanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:86041 name: 3-hydroxydecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65102 ! 3-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:86042 name: 2-methyl-3-oxopalmitoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:86043 name: O-acyl-D-carnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:86044 name: 18-hydroxyoleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:84204 ! omega-hydroxy fatty acyl-CoA(4-) [Term] id: CHEBI:86045 name: O-acetyl-D-carnitine subset: chebi_ph7_3 is_a: CHEBI:73024 ! O-acetylcarnitine is_a: CHEBI:86043 ! O-acyl-D-carnitine [Term] id: CHEBI:86046 name: 18-hydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:86048 name: 1-acyl-2-[(R)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:57643 ! 1,2-diacyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:86051 name: O-octanoyl-D-carnitine subset: chebi_ph7_3 is_a: CHEBI:73039 ! O-octanoylcarnitine is_a: CHEBI:86043 ! O-acyl-D-carnitine [Term] id: CHEBI:86053 name: 18-hydroxyoleoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85212 ! omega-hydroxy fatty acyl-CoA [Term] id: CHEBI:86055 name: ethyl hexanoate subset: chebi_ph7_3 is_a: CHEBI:78206 ! fatty acid ethyl ester is_a: CHEBI:87656 ! hexanoate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:86062 name: abietatriene subset: chebi_ph7_3 is_a: CHEBI:35190 ! diterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86066 name: O-tetradecenoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:86071 name: caffeyl alcohol subset: chebi_ph7_3 is_a: CHEBI:26004 ! phenylpropanoid is_a: CHEBI:33566 ! catechols [Term] id: CHEBI:86074 name: (24S,25)-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36864 ! 25-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:86077 name: O-butenoylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:86087 name: 4beta,24S-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86094 name: 1-tetradecanoyl-2-[(9Z,12Z)-octadecadienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66848 ! phosphatidylcholine 32:2 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:86096 name: (25R)-3beta-hydroxycholest-5-en-26-al subset: chebi_ph7_3 is_a: CHEBI:84145 ! 3beta-hydroxycholest-5-en-26-al [Term] id: CHEBI:86098 name: (25R)-3beta-hydroxycholest-5-en-26-oate subset: chebi_ph7_3 is_a: CHEBI:84146 ! 3beta-hydroxycholest-5-en-26-oate [Term] id: CHEBI:86102 name: 1-tetradecanoyl-2-[(5Z,8Z,11Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64423 ! phosphatidylcholine 34:4 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:86110 name: O-[S-(6Z)-hexadecenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:86113 name: (25R)-4beta,26-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86115 name: (25R)-3beta,4beta-dihydroxycholest-5-en-26-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36884 ! 26-oxo steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86116 name: (25R)-3beta,4beta-dihydroxycholest-5-en-26-oate(1-) subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86119 name: 1-hexadecanoyl-2-[(5Z,8Z,11Z)-icosatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:133631 ! 1-palmitoyl-2-icosatrienoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:86120 name: (11Z)-hexadec-11-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) [Term] id: CHEBI:86121 name: 1-hexadecanoyl-2-[(8Z,11Z,14Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:133631 ! 1-palmitoyl-2-icosatrienoyl-sn-glycero-3-phosphocholine [Term] id: CHEBI:86122 name: (10E,12Z)-hexadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:86128 name: 2-methyl-L-tryptophan is_a: CHEBI:47994 ! L-tryptophan derivative relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:8613 name: psilocin is_a: CHEBI:33853 ! phenols is_a: CHEBI:48274 ! tryptamine alkaloid is_a: CHEBI:50996 ! tertiary amino compound is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:35941 ! serotonergic agonist relationship: has_role CHEBI:49103 ! drug metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86131 name: 5alpha-cholesta-8,14-dien-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol [Term] id: CHEBI:86132 name: (9Z,12Z)-hexadeca-9,12,15-trienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:86133 name: 1-[(9Z)-octadecenoyl]-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64520 ! phosphatidylcholine 36:4 [Term] id: CHEBI:86135 name: (5Z,9Z,12Z,15Z)-octadecatetraenoic acid is_a: CHEBI:37810 ! octadecatetraenoic acid relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:86136 name: (5Z,9Z,12Z)-octadecatrienoic acid is_a: CHEBI:25633 ! octadecatrienoic acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86137 name: 1-hexadecanoyl-2-[(5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:64504 ! phosphatidylcholine 36:5 [Term] id: CHEBI:86139 name: N-methyl-L-alpha-amino acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:8614 name: psilocybin is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:48274 ! tryptamine alkaloid is_a: CHEBI:50996 ! tertiary amino compound relationship: has_role CHEBI:35499 ! hallucinogen relationship: has_role CHEBI:35941 ! serotonergic agonist relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:86141 name: (9Z,12E)-octadecadienoic acid is_a: CHEBI:25627 ! octadecadienoic acid [Term] id: CHEBI:86142 name: (9Z,12E)-hexadecadienoic acid is_a: CHEBI:77524 ! hexadecadienoic acid [Term] id: CHEBI:86143 name: (14Z)-hexadecenoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA [Term] id: CHEBI:86144 name: (14E)-hexadecenoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA [Term] id: CHEBI:86145 name: (7alpha,22R)-dihydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36863 ! 22-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:86146 name: (24S,25)-epoxy-7alpha-hydroxycholesterol subset: chebi_ph7_3 is_a: CHEBI:145217 ! epoxy steroid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:86147 name: (7Z,10Z)-hexadecadienoic acid is_a: CHEBI:77524 ! hexadecadienoic acid [Term] id: CHEBI:86148 name: (8E,10E,12Z)-octadecatrienoic acid is_a: CHEBI:36009 ! omega-6 fatty acid is_a: CHEBI:61160 ! conjugated linolenic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86160 name: (2E)-pentenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83324 ! pent-2-enoyl-CoA(4-) [Term] id: CHEBI:86162 name: 1-tetradecanoyl-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphocholine subset: chebi_ph7_3 is_a: CHEBI:66856 ! phosphatidylcholine 36:6 is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:86165 name: (24S,25S)-cholest-5-en-3beta,24,26-triol subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:36865 ! 24-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86226 name: lipid IIA(2-) subset: chebi_ph7_3 is_a: CHEBI:193144 ! a lipid IIA(2-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:86234 name: alpha-Kdo-(2->8)-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(7-) subset: chebi_ph7_3 is_a: CHEBI:192708 ! a (Kdo)3-lipid IVA(7-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:86236 name: alpha-Kdo-(2->8)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(8-) subset: chebi_ph7_3 is_a: CHEBI:193024 ! an alpha-Kdo-(2->8)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(8-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:86258 name: uridine-5'-aldehyde subset: chebi_ph7_3 is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:26440 ! pyrimidine nucleoside relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:86261 name: (3S)-beta-leucine is_a: CHEBI:72772 ! beta-leucine [Term] id: CHEBI:86262 name: D-kynurenine is_a: CHEBI:16733 ! D-alpha-amino acid is_a: CHEBI:28683 ! kynurenine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:86264 name: rat metabolite is_a: CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:86265 name: N-(1,2-saturated acyl)sphinganine subset: chebi_ph7_3 is_a: CHEBI:31488 ! N-acylsphinganine [Term] id: CHEBI:86266 name: N-[(2R)-hydroxyacyl]sphinganine subset: chebi_ph7_3 is_a: CHEBI:83247 ! N-(2-hydroxyacyl)sphinganine [Term] id: CHEBI:86273 name: 4-hydroxylysine is_a: CHEBI:86498 ! hydroxylysine [Term] id: CHEBI:86274 name: N-[(R)-2-hydroxyacyl]phytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:86275 name: N-(1,2-saturated acyl)phytosphingosine subset: chebi_ph7_3 is_a: CHEBI:31998 ! N-acylphytosphingosine [Term] id: CHEBI:86284 name: CMP-3-deoxy-beta-D-manno-octulosonic acid is_a: CHEBI:20878 ! CMP-sugar [Term] id: CHEBI:86287 name: GDP-N,N'-diacetylbacillosamine is_a: CHEBI:21167 ! GDP-hexose relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:86293 name: 3,22-dioxochol-4-en-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:86294 name: N-acyl-(4E,8E,10E)-sphinga-4,8,10-trienine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:86298 name: O-[S-5-hexenoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:86299 name: O-[S-5-hexynoylpantetheine-4'-phosphoryl]serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:8630 name: pterostilbene subset: chebi_ph7_3 is_a: CHEBI:36027 ! stilbenol is_a: CHEBI:46786 ! diether is_a: CHEBI:51683 ! methoxybenzenes relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35526 ! hypoglycemic agent relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:48578 ! radical scavenger relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86301 name: 20-methyl-3-oxopregna-4,17-dien-21-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:86305 name: 3beta-hydroxychol-5-en-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:86308 name: 17-hydroxy-3-oxopregn-4-en-20-carboxy-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:86315 name: methyl sulfide subset: chebi_ph7_3 is_a: CHEBI:16385 ! organic sulfide [Term] id: CHEBI:86316 name: 3beta-hydroxychola-5,22-dien-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:86317 name: 2-methyl-3-oxopalmitoyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:86319 name: 25-hydroxyvitamin D2 subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D is_a: CHEBI:36819 ! seco-ergostane is_a: CHEBI:47042 ! hydroxycalciol relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86320 name: 1alpha,25-dihydroxyvitamin D2 subset: chebi_ph7_3 is_a: CHEBI:27300 ! vitamin D is_a: CHEBI:36819 ! seco-ergostane is_a: CHEBI:47042 ! hydroxycalciol relationship: has_role CHEBI:50646 ! bone density conservation agent relationship: has_role CHEBI:50733 ! nutraceutical relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86321 name: 3-hydroxyoctanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:86322 name: alkaloid antibiotic is_a: CHEBI:22315 ! alkaloid relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:86323 name: conazole antifungal agent is_a: CHEBI:68452 ! azole relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:75282 ! ergosterol biosynthesis inhibitor [Term] id: CHEBI:86327 name: antifungal drug is_a: CHEBI:23888 ! drug is_a: CHEBI:35441 ! antiinfective agent is_a: CHEBI:35718 ! antifungal agent [Term] id: CHEBI:86328 name: antifungal agrochemical is_a: CHEBI:24127 ! fungicide is_a: CHEBI:25944 ! pesticide is_a: CHEBI:33286 ! agrochemical [Term] id: CHEBI:86338 name: 3-hydroxydecanoyl-CoA is_a: CHEBI:20060 ! 3-hydroxy fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:86339 name: D-5-monosubstituted hydantoin subset: chebi_ph7_3 is_a: CHEBI:24628 ! imidazolidine-2,4-dione [Term] id: CHEBI:86340 name: L-5-monosubstituted hydantoin subset: chebi_ph7_3 is_a: CHEBI:24628 ! imidazolidine-2,4-dione [Term] id: CHEBI:86359 name: L-gluconic acid is_a: CHEBI:24266 ! gluconic acid [Term] id: CHEBI:86363 name: 2-dehydro-L-gluconic acid is_a: CHEBI:24967 ! ketogluconic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:86375 name: (11Z)-hexadec-11-enoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA [Term] id: CHEBI:86376 name: (10E,12Z)-hexadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:86377 name: 5beta-dihydroepitestosterone subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:35342 ! 17alpha-hydroxy steroid is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86378 name: (25R)-3beta-hydroxycholest-5-en-26-oic acid is_a: CHEBI:81014 ! 3beta-hydroxycholest-5-en-26-oic acid [Term] id: CHEBI:86379 name: alpha-Kdo-(2->8)-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:8638 name: (9Z,11E,13Z)-octadecatrienoic acid is_a: CHEBI:38382 ! 9,11,13-octadecatrienoic acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86381 name: 5beta-dihydrocorticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86382 name: alpha-Kdo-(2->8)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:86384 name: 5beta-dihydrodeoxycorticosterone subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86386 name: 3-mercaptopropionate subset: chebi_ph7_3 is_a: CHEBI:78113 ! fatty acid anion 3:0 relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:86389 name: 5beta-dihydroaldosterone subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:139590 ! primary alpha-hydroxy ketone is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:35346 ! 11beta-hydroxy steroid is_a: CHEBI:36885 ! 20-oxo steroid is_a: CHEBI:36887 ! 18-oxo steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86392 name: 4-guanidinobutanoate is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:86394 name: 5-aminopentanoate is_a: CHEBI:61007 ! amino fatty acid anion [Term] id: CHEBI:86399 name: (4R,6R)-hydroxy-2,2,6-trimethylcyclohexanone subset: chebi_ph7_3 is_a: CHEBI:24693 ! hydroxycyclohexanone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:864 name: (S)-2,3,4,5-tetrahydrodipicolinic acid is_a: CHEBI:32976 ! 2,3,4,5-tetrahydrodipicolinic acid [Term] id: CHEBI:86400 name: levodione subset: chebi_ph7_3 is_a: CHEBI:23482 ! cyclohexanones relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:86401 name: N-Acetyldemethylphosphinothricinate (2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity [Term] id: CHEBI:86412 name: 3-oxochol-4-en-24-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86414 name: 3-oxocholesta-4,24-dien-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:86420 name: imidazole antifungal agent is_a: CHEBI:24780 ! imidazoles relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:86421 name: 2-nitrophenols is_a: CHEBI:39362 ! mononitrophenol [Term] id: CHEBI:86426 name: triazole antifungal agent is_a: CHEBI:35727 ! triazoles relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:86433 name: 4-hydroxybenzoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:86434 name: (25R)-3beta,4beta-dihydroxycholest-5-en-26-oic acid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:86435 name: 4-hydroxybenzoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:86441 name: (2E)-pentenoyl-CoA is_a: CHEBI:27962 ! pent-2-enoyl-CoA [Term] id: CHEBI:86457 name: 2-hydroxybenzoyl-AMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride [Term] id: CHEBI:86458 name: 2-hydroxybenzoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:86459 name: (R)-lipoyl-GMP is_a: CHEBI:37021 ! purine ribonucleoside 5'-monophosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride is_a: CHEBI:39192 ! dithiolanes relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:86460 name: (R)-lipoyl-GMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:86462 name: O-(S-2-hydroxybenzoylpantetheine-4'-phosphoryl)-L-serine residue is_a: CHEBI:76241 ! O-(S-acylpantetheine-4'-phosphoryl)serine residue [Term] id: CHEBI:86464 name: O-(S-2-hydroxybenzoylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:86468 name: dimethylarginine is_a: CHEBI:22617 ! arginine derivative [Term] id: CHEBI:86469 name: peptidoglycosaminoglycan is_a: CHEBI:18085 ! glycosaminoglycan [Term] id: CHEBI:86478 name: antibiotic antifungal agent is_a: CHEBI:33285 ! heteroorganic entity relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:86490 name: C4-acylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:86492 name: C5-acylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:86493 name: C9-acylcarnitine subset: chebi_ph7_3 is_a: CHEBI:17387 ! O-acylcarnitine [Term] id: CHEBI:86494 name: botanical anti-fungal agent is_a: CHEBI:33285 ! heteroorganic entity relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86496 name: acetyl-L-ornithine is_a: CHEBI:21368 ! L-ornithine derivative is_a: CHEBI:21545 ! N-acetyl-L-amino acid [Term] id: CHEBI:86497 name: hydroxykynurenine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:48975 ! substituted aniline [Term] id: CHEBI:86498 name: hydroxylysine is_a: CHEBI:24662 ! hydroxy-amino acid is_a: CHEBI:53079 ! lysine derivative [Term] id: CHEBI:86499 name: monohydroxyproline is_a: CHEBI:24741 ! hydroxyproline [Term] id: CHEBI:86500 name: N-myristoylglycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:86506 name: (9Z,12Z)-octadeca-9,12-dien-6-ynoic acid is_a: CHEBI:15904 ! long-chain fatty acid is_a: CHEBI:25380 ! acetylenic fatty acid is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:59202 ! straight-chain fatty acid [Term] id: CHEBI:86508 name: alpha-aminobutyrate is_a: CHEBI:33558 ! alpha-amino-acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:86520 name: (2R)-2-methyltetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57313 ! (2R)-2-methylacyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:86521 name: (2S)-2-methyltetradecanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57314 ! (2S)-2-methylacyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:8653 name: pyocyanine is_a: CHEBI:35285 ! iminium betaine is_a: CHEBI:39201 ! phenazines relationship: has_role CHEBI:26130 ! biological pigment relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:72316 ! virulence factor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:86542 name: 2-hydroxyhexanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid relationship: has_role CHEBI:75767 ! animal metabolite [Term] id: CHEBI:86543 name: 2-hydroxyoctanoic acid is_a: CHEBI:24654 ! hydroxy fatty acid [Term] id: CHEBI:86564 name: 4-guanidinobutyric acid is_a: CHEBI:24436 ! guanidines is_a: CHEBI:25384 ! monocarboxylic acid [Term] id: CHEBI:86570 name: (5alpha)-cholestan-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:86644 name: Gibberellic acid is_a: CHEBI:20858 ! C19-gibberellin is_a: CHEBI:38305 ! gibberellin monocarboxylic acid [Term] id: CHEBI:86910 name: N-acetylhistidine is_a: CHEBI:21575 ! N-acetyl-amino acid is_a: CHEBI:24599 ! histidine derivative [Term] id: CHEBI:8695 name: quercetagetin is_a: CHEBI:24561 ! hexahydroxyflavone is_a: CHEBI:28802 ! flavonols relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:22587 ! antiviral agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:86962 name: veratryl glycerol subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:51681 ! dimethoxybenzene [Term] id: CHEBI:86963 name: veratrylglycerol beta-guaiacyl ether subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:51681 ! dimethoxybenzene [Term] id: CHEBI:86980 name: diacylglycerol 36:1 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:86982 name: (2R)-2,6-dimethylheptanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:84847 ! 2,6-dimethylheptanoyl-CoA(4-) [Term] id: CHEBI:86983 name: (2S)-2,6-dimethylheptanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:84847 ! 2,6-dimethylheptanoyl-CoA(4-) [Term] id: CHEBI:86987 name: diacylglycerol 36:0 subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride [Term] id: CHEBI:86990 name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83565 ! (trifluoromethyl)benzenes [Term] id: CHEBI:86991 name: (R)-fluoxetine is_a: CHEBI:86990 ! N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor [Term] id: CHEBI:86992 name: (S)-fluoxetine is_a: CHEBI:86990 ! N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine relationship: has_role CHEBI:35469 ! antidepressant relationship: has_role CHEBI:50949 ! serotonin uptake inhibitor [Term] id: CHEBI:86993 name: (R)-fluoxetine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:86994 name: carboxyphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:86995 name: (S)-fluoxetine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:86999 name: 1-acyl-2-palmitoylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87000 name: 1-acyl-2-[(7Z)-hexadec-7-enoyl]-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87002 name: 1-acyl-2-[(3E)-hexadec-3-enoyl]-glycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87003 name: 1-acyl-2-palmitoleoylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87007 name: 1-stearoyl 2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:167498 ! 1-(1,2-saturated-acyl)-2-acyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87008 name: 1-oleoyl-2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:167498 ! 1-(1,2-saturated-acyl)-2-acyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87010 name: 1-linoleoyl-2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:167498 ! 1-(1,2-saturated-acyl)-2-acyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87017 name: 1-gamma-linolenoyl 2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:90081 ! gamma-linolenoyl-containing glycerolipid [Term] id: CHEBI:87023 name: 1-alpha-linolenoyl 2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:90078 ! alpha-linolenoyl-containing glycerolipid [Term] id: CHEBI:87024 name: 1-[(6Z,9Z,12Z,15Z)-octadec-6,9,12,15-tetraenoyl]-2-acylglycerolipid subset: chebi_ph7_3 is_a: CHEBI:144368 ! 1,2-diacyl-sn-glycerolipid is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:87033 name: N-acyl-(4E,8E)-9-methylsphinga-4,8-dienine subset: chebi_ph7_3 is_a: CHEBI:17761 ! ceramide [Term] id: CHEBI:87034 name: aromatic fungicide is_a: CHEBI:33659 ! organic aromatic compound relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87036 name: benzimidazole fungicide is_a: CHEBI:22715 ! benzimidazoles relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87044 name: 4,4-dimethyl-5alpha-cholest-8-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:26893 ! tetracyclic triterpenoid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:87045 name: 4alpha-hydroxymethyl-4beta-methyl-5alpha-8-cholesten-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87046 name: 4alpha-formyl-4beta-methyl-5alpha-8-cholesten-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:145353 ! 3beta-hydroxy-4alpha-formyl-4beta-methylsteroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87047 name: 3beta-hydroxy-4beta-methyl-5alpha-cholest-8-ene-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87048 name: palmitoyllipid A(4-) subset: chebi_ph7_3 is_a: CHEBI:193142 ! an acyl-lipid A(4-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:87049 name: lipid IVB(4-) subset: chebi_ph7_3 is_a: CHEBI:193143 ! a lipid IVB(4-) is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:87050 name: 4alpha-methyl-5alpha-cholest-8-en-3-one subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87051 name: 4alpha-methyl-5alpha-cholest-8-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87053 name: 4alpha-hydroxymethyl-5alpha-cholest-8-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87054 name: 4alpha-formyl-5alpha-cholest-8-en-3beta-ol subset: chebi_ph7_3 is_a: CHEBI:145954 ! 4alpha-formyl steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87055 name: 3beta-hydroxy-5alpha-cholest-8-ene-4alpha-carboxylate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87056 name: 5alpha-cholest-8-en-3-one subset: chebi_ph7_3 is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50401 ! cholestanoid [Term] id: CHEBI:87058 name: lipid IIB(2-) subset: chebi_ph7_3 is_a: CHEBI:193145 ! a lipid IIB(2-) is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:87061 name: carbamate fungicide is_a: CHEBI:23003 ! carbamate ester relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87064 name: benzimidazolylcarbamate fungicide is_a: CHEBI:22715 ! benzimidazoles is_a: CHEBI:87061 ! carbamate fungicide relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87068 name: imidazole fungicide is_a: CHEBI:86420 ! imidazole antifungal agent relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87069 name: imidazole antifungal drug is_a: CHEBI:86420 ! imidazole antifungal agent relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:8707 name: quetiapine is_a: CHEBI:39268 ! dibenzothiazepine is_a: CHEBI:46845 ! N-alkylpiperazine is_a: CHEBI:46848 ! N-arylpiperazine relationship: has_role CHEBI:37887 ! adrenergic antagonist relationship: has_role CHEBI:37956 ! histamine antagonist relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:65191 ! second generation antipsychotic [Term] id: CHEBI:87071 name: conazole antifungal drug is_a: CHEBI:68452 ! azole is_a: CHEBI:86323 ! conazole antifungal agent relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:87075 name: O-(N-acetyl-alpha-D-galactosaminyl)-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue relationship: has_role CHEBI:53000 ! epitope [Term] id: CHEBI:87079 name: N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:87080 name: N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:87082 name: 3-[beta-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-diacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:63428 ! digalactosylglycerol derivative [Term] id: CHEBI:87089 name: 2-O-(alpha-D-glucosyl)-sn-glycerol 3-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87090 name: (7R)-6-deoxy-D-manno-oct-7-ulosuronate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:87091 name: 8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:87095 name: lipid A 1-(2-aminoethyl diphosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:134351 ! lipid A 1-(2-aminoethyl diphosphate) oxoanion is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:87096 name: lipid A 1,4'-bis(2-aminoethyl diphosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:60086 ! lipid A oxoanion [Term] id: CHEBI:87097 name: lipid A 4'-(2-aminoethyl diphosphate)(3-) subset: chebi_ph7_3 is_a: CHEBI:134350 ! lipid A 4'-(2-aminoethyl diphosphate) oxoanion [Term] id: CHEBI:87101 name: triazole antifungal drug is_a: CHEBI:86426 ! triazole antifungal agent relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:87107 name: 7-O-[(2-aminoethyl)phosphoryl]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA(6-) subset: chebi_ph7_3 is_a: CHEBI:60373 ! lipid IVA oxoanion [Term] id: CHEBI:87109 name: juvenile hormone I carboxylate subset: chebi_ph7_3 is_a: CHEBI:58955 ! branched-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:87113 name: antibiotic antifungal drug is_a: CHEBI:86478 ! antibiotic antifungal agent relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:87114 name: antibiotic fungicide is_a: CHEBI:86478 ! antibiotic antifungal agent relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87119 name: (R)-2-hydroxy-4-methylpentanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:157766 ! 2-hydroxy-fatty acyl-CoA(4-) is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:87120 name: 4-methylpent-2-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:87121 name: bisanhydrobacterioruberin subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:87165 ! C50 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87122 name: monoanhydrobacterioruberin subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:27136 ! triol is_a: CHEBI:87165 ! C50 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87123 name: tulipalin B subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:51702 ! enoate ester relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:87124 name: 6-tuliposide B subset: chebi_ph7_3 is_a: CHEBI:51702 ! enoate ester is_a: CHEBI:59475 ! 6-O-acyl-D-glucose relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:87125 name: 5-epi-valiolone 7-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87128 name: benzofuran antifungal drug is_a: CHEBI:35259 ! benzofurans relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:87131 name: O-(S-L-2-amino-6-adipoylpantetheine-4'-phosphoryl)-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:87133 name: 7-methyl-GTP(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87136 name: trans-caffeoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57372 ! caffeoyl-CoA(4-) [Term] id: CHEBI:87137 name: dihydrocaffeoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:87139 name: 3-oxochol-4-en-24-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:87141 name: 3-oxocholesta-4,24-dien-26-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA [Term] id: CHEBI:87142 name: N-myristoylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:87161 name: dihydrobisanhydrobacterioruberin subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:87165 ! C50 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87162 name: isopentenyldehydrorhodopin subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:87168 ! C45 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87163 name: dihydroisopentenyldehydrorhodopin subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:87168 ! C45 carotenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87164 name: 6-hydroxy-N-methylmyosmine(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:87165 name: C50 carotenoid is_a: CHEBI:26207 ! polyterpenoid [Term] id: CHEBI:87167 name: S-[(2E,6E)-farnesyl]-L-cysteine methyl ester is_a: CHEBI:46874 ! alpha-amino acid ester is_a: CHEBI:83824 ! L-cysteine derivative [Term] id: CHEBI:87168 name: C45 carotenoid is_a: CHEBI:26207 ! polyterpenoid [Term] id: CHEBI:87169 name: S-sulfo-L-cysteine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:87170 name: 2-thiouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:87171 name: 5-taurinomethyl-2-thiouridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group relationship: has_part CHEBI:139020 ! taurino group [Term] id: CHEBI:87172 name: 5-taurinomethyluridine 5'-phosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group relationship: has_part CHEBI:139020 ! taurino group [Term] id: CHEBI:87173 name: (2R)-2-methyltetradecanoyl-CoA is_a: CHEBI:15450 ! (2R)-2-methylacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:87181 name: (2R)-2,6-dimethylheptanoyl-CoA is_a: CHEBI:85504 ! 2,6-dimethylheptanoyl-CoA [Term] id: CHEBI:87182 name: (2S)-2,6-dimethylheptanoyl-CoA is_a: CHEBI:85504 ! 2,6-dimethylheptanoyl-CoA [Term] id: CHEBI:87195 name: dicarboximide fungicide is_a: CHEBI:87200 ! dicarboximide antifungal agent relationship: has_role CHEBI:24127 ! fungicide [Term] id: CHEBI:87197 name: dichlorophenyl dicarboximide fungicide is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:87195 ! dicarboximide fungicide [Term] id: CHEBI:87200 name: dicarboximide antifungal agent is_a: CHEBI:35356 ! dicarboximide relationship: has_role CHEBI:35718 ! antifungal agent [Term] id: CHEBI:87215 name: N-terminal 5-oxo-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:33715 ! N-terminal alpha-amino-acid residue [Term] id: CHEBI:87228 name: sulfonamide antibiotic is_a: CHEBI:35358 ! sulfonamide relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:87230 name: nitrofuran antibiotic is_a: CHEBI:24129 ! furans is_a: CHEBI:25558 ! organonitrogen heterocyclic antibiotic is_a: CHEBI:25807 ! organooxygen heterocyclic antibiotic is_a: CHEBI:35716 ! C-nitro compound relationship: has_role CHEBI:33281 ! antimicrobial agent [Term] id: CHEBI:87242 name: palmitoyllipid A is_a: CHEBI:25051 ! lipid As is_a: CHEBI:25835 ! hexadecanoate ester is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87244 name: lipid IVB is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:87245 name: lipid IIB is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:87251 name: monoacylglycerol 16:0 subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87255 name: monoacylglycerol 18:0 subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87256 name: monoacylglycerol 18:1 subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87257 name: monoacylglycerol 18:2 subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87259 name: (E)-2-methylpentadec-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA is_a: CHEBI:61912 ! branched-chain fatty acyl-CoA [Term] id: CHEBI:87260 name: O-[N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyl]-L-serine is_a: CHEBI:21957 ! O-glycosyl-L-serine is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:87277 name: 3beta-hydroxy-4beta-methyl-5alpha-cholest-8-ene-4alpha-carboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87287 name: 4beta-methylzymosterol-4-carbaldehyde subset: chebi_ph7_3 is_a: CHEBI:145954 ! 4alpha-formyl steroid is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87289 name: 4alpha-hydroxymethyl-4beta-methylzymosterol subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:35348 ! 3beta-sterol relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87293 name: 3beta-hydroxy-5alpha-cholest-8-ene-4alpha-carboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87300 name: 2-O-(alpha-D-glucosyl)-sn-glycerol 3-phosphate is_a: CHEBI:24286 ! glucosylglycerol phosphate [Term] id: CHEBI:87305 name: trans-feruloyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57276 ! feruloyl-CoA(4-) [Term] id: CHEBI:87306 name: (7R)-6-deoxy-D-manno-oct-7-ulosuronic acid is_a: CHEBI:17478 ! aldehyde is_a: CHEBI:24963 ! ketoaldonic acid [Term] id: CHEBI:87313 name: 8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid is_a: CHEBI:60926 ! amino monosaccharide is_a: CHEBI:63436 ! carbohydrate acid derivative [Term] id: CHEBI:87331 name: 17beta-hydroxy-5beta-androst-1-en-3-one subset: chebi_ph7_3 is_a: CHEBI:20156 ! 3-oxo-Delta(1) steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87333 name: 17beta-hydroxy-5beta-estran-3-one subset: chebi_ph7_3 is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87339 name: lipid A 1-(2-aminoethyl diphosphate) is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:87356 name: (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-decaprenyl diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87362 name: pentyl acetate subset: chebi_ph7_3 is_a: CHEBI:47622 ! acetate ester relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:87373 name: pentyl propanoate subset: chebi_ph7_3 is_a: CHEBI:36243 ! propanoate ester relationship: has_role CHEBI:76946 ! fungal metabolite [Term] id: CHEBI:87391 name: N-icosanoylglycinate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:87410 name: N-docosanoylglycinate subset: chebi_ph7_3 is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:87414 name: N-hexacosanoylglycinate subset: chebi_ph7_3 is_a: CHEBI:149742 ! N-(fatty acyl)-glycine(1-) is_a: CHEBI:57670 ! N-acylglycinate [Term] id: CHEBI:87415 name: 7-O-[(2-aminoethyl)phosphoryl]-alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA is_a: CHEBI:25051 ! lipid As [Term] id: CHEBI:87420 name: lipid A 4'-(2-aminoethyl diphosphate) is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87659 ! dodecanoate ester is_a: CHEBI:87691 ! tetradecanoate ester [Term] id: CHEBI:87424 name: lipid A 1,4'-bis(2-aminoethyl diphosphate) is_a: CHEBI:25051 ! lipid As is_a: CHEBI:87691 ! tetradecanoate ester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87425 name: juvenile hormone I acid is_a: CHEBI:24943 ! juvenile hormone is_a: CHEBI:26208 ! polyunsaturated fatty acid is_a: CHEBI:35819 ! branched-chain fatty acid is_a: CHEBI:53339 ! olefinic fatty acid is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:87433 name: (R)-2-hydroxy-4-methylpentanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:87435 name: 11-cis-retinoate subset: chebi_ph7_3 is_a: CHEBI:15036 ! retinoate [Term] id: CHEBI:87436 name: 4-methylpent-2-enoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15469 ! alk-2-enoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61905 ! short-chain fatty acyl-CoA [Term] id: CHEBI:87438 name: lithocholyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138842 ! 3alpha-hydroxy bile acid CoA thioester(4-) is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:87447 name: 5-epi-valiolone 7-phosphate is_a: CHEBI:23451 ! cyclitol is_a: CHEBI:36132 ! alicyclic ketone is_a: CHEBI:7794 ! phosphate monoester relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87449 name: trans-caffeoyl-CoA is_a: CHEBI:15518 ! caffeoyl-CoA [Term] id: CHEBI:87451 name: dihydrocaffeoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:87460 name: 6-hydroxy-N-methylmyosmine is_a: CHEBI:23763 ! pyrroline is_a: CHEBI:38182 ! monohydroxypyridine relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:87467 name: prenyl-FMNH2(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87474 name: (R)-2-hydroxybutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:87475 name: (R)-2-hydroxybutanoyl-CoA is_a: CHEBI:139303 ! 2-hydroxybutanoyl-CoA [Term] id: CHEBI:87476 name: (25R)-7alpha,26-dihydroxycholest-4-en-3-one subset: chebi_ph7_3 is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:47788 ! 3-oxo steroid is_a: CHEBI:50401 ! cholestanoid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87487 name: short-chain 3-substituted propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) [Term] id: CHEBI:87488 name: short-chain 2,3-trans-enoyl CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) [Term] id: CHEBI:87491 name: (2R,3E)-5-oxopent-3-ene-1,2,5-tricarboxylate subset: chebi_ph7_3 is_a: CHEBI:27092 ! tricarboxylic acid trianion [Term] id: CHEBI:87504 name: (2Z,4Z)-2-hydroxyhepta-2,4-dienedioate subset: chebi_ph7_3 is_a: CHEBI:133492 ! polyunsaturated dicarboxylic acid dianion [Term] id: CHEBI:87507 name: (4Z)-2-oxohept-4-enedioate subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion [Term] id: CHEBI:87509 name: (2R,3E)-5-oxopent-3-ene-1,2,5-tricarboxylic acid is_a: CHEBI:27093 ! tricarboxylic acid [Term] id: CHEBI:87518 name: ADP(2-) is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87522 name: (S)-4-hydroxy-2-oxoheptanedioate subset: chebi_ph7_3 is_a: CHEBI:73036 ! 4-hydroxy-2-oxoheptanedioate [Term] id: CHEBI:87531 name: prenyl-FMNH2 is_a: CHEBI:24041 ! flavin mononucleotide is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:87538 name: 16alpha-hydroxydehydroepiandrosterone 3-sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:167106 ! androstane conjugate is_a: CHEBI:59696 ! steroid sulfate oxoanion [Term] id: CHEBI:87571 name: 6beta-hydroxyandrost-4-ene-3,17-dione subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid [Term] id: CHEBI:87584 name: N(2)-acyl-L-glutaminate subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:87593 name: 15alpha-hydroxyestradiol subset: chebi_ph7_3 is_a: CHEBI:33853 ! phenols is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:83147 ! 15alpha-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:83399 ! marine xenobiotic metabolite [Term] id: CHEBI:87598 name: 7alpha-hydroxyestradiol subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87602 name: 4-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33566 ! catechols is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:62846 ! 4-hydroxy steroid relationship: has_role CHEBI:50114 ! estrogen relationship: has_role CHEBI:50903 ! carcinogenic agent relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:87605 name: 6alpha-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36850 ! 6alpha-hydroxy steroid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:87606 name: N-icosanoylglycine is_a: CHEBI:16180 ! N-acylglycine [Term] id: CHEBI:87618 name: 15alpha-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:83147 ! 15alpha-hydroxy steroid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76968 ! fungal xenobiotic metabolite [Term] id: CHEBI:87620 name: 16beta-hydroxyestradiol subset: chebi_ph7_3 is_a: CHEBI:17354 ! 16beta-hydroxy steroid is_a: CHEBI:177917 ! phenolic steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:36834 ! 3-hydroxy steroid relationship: has_role CHEBI:35472 ! anti-inflammatory drug relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87623 name: methanediimine subset: chebi_ph7_3 is_a: CHEBI:53091 ! carbodiimide [Term] id: CHEBI:87626 name: 6beta-hydroxyestrone subset: chebi_ph7_3 is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:33853 ! phenols is_a: CHEBI:36834 ! 3-hydroxy steroid is_a: CHEBI:36851 ! 6beta-hydroxy steroid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87631 name: statin is_a: CHEBI:36963 ! organooxygen compound relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:35821 ! anticholesteremic drug [Term] id: CHEBI:87632 name: statin (naturally occurring) is_a: CHEBI:87631 ! statin relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:87633 name: statin (semi-synthetic) is_a: CHEBI:72588 ! semisynthetic derivative is_a: CHEBI:87631 ! statin [Term] id: CHEBI:87653 name: (25R)-3beta,26-dihydroxycholest-5-en-7-one subset: chebi_ph7_3 is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36852 ! 26-hydroxy steroid is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87656 name: hexanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:87657 name: octanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:87658 name: decanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:87659 name: dodecanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:87673 name: 2-O-(alpha-D-mannopyranosyl)-1-phosphatidyl-1D-myo-inositol(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87677 name: (25R)-3beta-hydroxycholest-5-en-7-one-26-al subset: chebi_ph7_3 is_a: CHEBI:131565 ! steroid aldehyde is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:36884 ! 26-oxo steroid is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol [Term] id: CHEBI:87678 name: (25R)-3beta-hydroxycholest-5-en-7-one-26-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87687 name: (3S)-3-hydroxyoleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136757 ! long-chain (3S)-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:87691 name: tetradecanoate ester subset: chebi_ph7_3 is_a: CHEBI:35748 ! fatty acid ester [Term] id: CHEBI:87695 name: 3-oxooleoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136758 ! long-chain 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:87698 name: (7Z)-hexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) [Term] id: CHEBI:87700 name: (24E)-3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:87701 name: (2E,5Z)-tetradecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85097 ! 4-saturated trans-2-enoyl-CoA(4-) [Term] id: CHEBI:87702 name: (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:87704 name: 3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:131622 ! steroidal acyl-CoA(4-) [Term] id: CHEBI:87705 name: (3S,5Z)-3-hydroxytetradec-5-enoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136757 ! long-chain (3S)-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:57318 ! (S)-3-hydroxyacyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:87707 name: (5Z)-3-oxotetradecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:87710 name: (3E)-tetradecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58521 ! trans-3-enoyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:87712 name: (2E,4E)-tetradecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85111 ! 6-saturated-trans,trans-2,4-dienoyl-CoA(4-) [Term] id: CHEBI:87717 name: (2E,7Z)-hexadecadienoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77330 ! polyunsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) is_a: CHEBI:85100 ! 4,5-saturated-trans-2-enoyl-CoA(4-) [Term] id: CHEBI:87718 name: (3S,7Z)-3-hydroxyhexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:136757 ! long-chain (3S)-hydroxy fatty acyl-CoA(4-) is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:87719 name: (7Z)-3-oxohexadecenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:139572 ! hexadecenoyl-CoA(4-) is_a: CHEBI:57347 ! 3-oxo-fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:83139 ! long-chain fatty acyl-CoA(4-) [Term] id: CHEBI:87728 name: isolithocholate subset: chebi_ph7_3 is_a: CHEBI:131878 ! cholanic acid anion is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87730 name: 3beta,7alpha-dihydroxy-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87731 name: 7alpha-hydroxy-3-oxo-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87733 name: 3beta,12alpha-dihydroxy-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87734 name: 12alpha-hydroxy-3-oxo-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87735 name: 3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87736 name: 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87747 name: 7alpha-hydroxy-3-oxochol-4-en-24-oate subset: chebi_ph7_3 is_a: CHEBI:36235 ! bile acid anion [Term] id: CHEBI:87748 name: 3-oxochola-4,6-dien-24-oate subset: chebi_ph7_3 is_a: CHEBI:50160 ! steroid acid anion [Term] id: CHEBI:87751 name: ocimene is_a: CHEBI:35187 ! monoterpene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:87753 name: D-gulonic acid is_a: CHEBI:24462 ! gulonic acid [Term] id: CHEBI:87764 name: N-docosanoylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:87765 name: L-ribonic acid is_a: CHEBI:33511 ! ribonic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:87766 name: 2-(D-glucosyloxy)benzoic acid is_a: CHEBI:22723 ! benzoic acids is_a: CHEBI:35436 ! D-glucoside is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:87768 name: N-hexacosanoylglycine is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:29348 ! fatty amide relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:87769 name: lithocholyl-CoA is_a: CHEBI:23218 ! choloyl-CoAs relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87771 name: (2Z,4Z)-2-hydroxyhepta-2,4-dienedioic acid is_a: CHEBI:134531 ! polyunsaturated dicarboxylic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:33823 ! enol [Term] id: CHEBI:87772 name: (4Z)-2-oxohept-4-enedioic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:36145 ! oxo dicarboxylic acid is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:87773 name: (S)-4-hydroxy-2-oxoheptanedioic acid is_a: CHEBI:73089 ! 4-hydroxy-2-oxoheptanedioic acid [Term] id: CHEBI:87774 name: 16alpha-hydroxydehydroepiandrosterone 3-sulfate is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:16799 ! 16alpha-hydroxy steroid is_a: CHEBI:19168 ! 17-oxo steroid is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:50402 ! androstanoid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87781 name: (3S)-3-hydroxyoleoyl-CoA is_a: CHEBI:137639 ! long-chain (3S)-hydroxy fatty acyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA [Term] id: CHEBI:87783 name: (25R)-3beta-hydroxycholest-5-en-7-one-26-oic acid is_a: CHEBI:1722 ! 3beta-hydroxy-Delta(5)-steroid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:35348 ! 3beta-sterol is_a: CHEBI:47789 ! 7-oxo steroid is_a: CHEBI:47891 ! steroid acid is_a: CHEBI:50401 ! cholestanoid is_a: CHEBI:53030 ! oxysterol relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87785 name: beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:82939 ! beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) is_a: CHEBI:88057 ! ganglioside GD1(2-) [Term] id: CHEBI:87787 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNac-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:88057 ! ganglioside GD1(2-) is_a: CHEBI:90856 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNac-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-ceramide(2-) [Term] id: CHEBI:87788 name: beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:141748 ! N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) is_a: CHEBI:88078 ! trisialotriglycosylceramide(3-) [Term] id: CHEBI:87789 name: beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:141743 ! beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(3-) is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88058 ! ganglioside GT1(3-) [Term] id: CHEBI:87791 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(4-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88059 ! ganglioside GQ1(4-) is_a: CHEBI:90513 ! alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-Cer(4-) [Term] id: CHEBI:87792 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(5-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88060 ! ganglioside GP1(5-) is_a: CHEBI:90512 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-Cer(5-) [Term] id: CHEBI:87802 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(5-) subset: chebi_ph7_3 is_a: CHEBI:141697 ! N-acetyl-alpha-neuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-alpha-neuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->8)-N-acetyl-alpha-neuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(5-) is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:88060 ! ganglioside GP1(5-) [Term] id: CHEBI:87803 name: 3-(m-hydroxyphenyl)propanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:87804 name: 3,3',5-trihydroxybibenzyl subset: chebi_ph7_3 is_a: CHEBI:26195 ! polyphenol is_a: CHEBI:33572 ! resorcinols is_a: CHEBI:51571 ! diphenylethane relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:87805 name: ethionamide S-oxide subset: chebi_ph7_3 is_a: CHEBI:26421 ! pyridines relationship: has_role CHEBI:33231 ! antitubercular agent relationship: has_role CHEBI:35679 ! antilipemic drug relationship: has_role CHEBI:35816 ! leprostatic drug relationship: has_role CHEBI:50185 ! fatty acid synthesis inhibitor relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:87808 name: 2-ethylhexyl sulfate(1-) subset: chebi_ph7_3 is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:87809 name: 2-ethylhexanal subset: chebi_ph7_3 is_a: CHEBI:133249 ! saturated fatty aldehyde relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:87810 name: 3-methylmalate(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:87817 name: D-ribitol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87824 name: methionine sulfone zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:87825 name: N-acetylmethionine sulfone(1-) subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:87826 name: L-methionine sulfoximine zwitterion subset: chebi_ph7_3 is_a: CHEBI:59869 ! L-alpha-amino acid zwitterion [Term] id: CHEBI:87827 name: N-acetyl-L-methionine sulfoximine(1-) subset: chebi_ph7_3 is_a: CHEBI:59874 ! N-acyl-L-alpha-amino acid anion [Term] id: CHEBI:87828 name: N(6)-glutaryl-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:87829 name: 2''-O-glutaryl-ADP-D-ribose(3-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:87830 name: N(6)-succinyl-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:87831 name: N(6)-malonyl-L-lysine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:87832 name: 2''-O-succinyl-ADP-D-ribose(3-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:87833 name: 2''-O-malonyl-ADP-D-ribose(3-) subset: chebi_ph7_3 is_a: CHEBI:138087 ! O-acyl-ADP-D-ribose(2-) is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:87834 name: (S)-4-hydroxy-1-pyrroline-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:26457 ! 1-pyrrolinecarboxylate is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion [Term] id: CHEBI:87835 name: framycetin(6+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:87836 name: 2-O-[alpha-D-mannosyl-(1->2)-alpha-D-glucosyl]-D-glycerate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:87837 name: ketocytochalasin subset: chebi_ph7_3 is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:51689 ! enone is_a: CHEBI:74222 ! gamma-lactam is_a: CHEBI:75946 ! cytochalasan alkaloid relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:87838 name: iso-precytochalasin subset: chebi_ph7_3 is_a: CHEBI:25106 ! macrolide is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:74222 ! gamma-lactam is_a: CHEBI:75946 ! cytochalasan alkaloid relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:87839 name: cytochalasin Z16 subset: chebi_ph7_3 is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:46838 ! cyclic carbonate ester is_a: CHEBI:51026 ! macrocycle is_a: CHEBI:74222 ! gamma-lactam is_a: CHEBI:75946 ! cytochalasan alkaloid relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:87840 name: cis-3-hydroxy-D-proline zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:87841 name: 4-pregnen-20,21-diol-3-one subset: chebi_ph7_3 is_a: CHEBI:35344 ! 21-hydroxy steroid is_a: CHEBI:36854 ! 20-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:50781 ! EC 1.3.1.22 [3-oxo-5alpha-steroid 4-dehydrogenase (NADP(+))] inhibitor relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:87842 name: 1,4-naphthoquinone-2-carboxylate subset: chebi_ph7_3 is_a: CHEBI:35979 ! dioxo monocarboxylic acid anion [Term] id: CHEBI:87844 name: 2-phytyl-1,4-dihydroxynaphthalene subset: chebi_ph7_3 is_a: CHEBI:23783 ! naphthalenediols is_a: CHEBI:51475 ! naphthohydroquinone is_a: CHEBI:78840 ! olefinic compound [Term] id: CHEBI:87846 name: 3-hydroxy-O,5-dimethyl-L-tyrosine zwitterion subset: chebi_ph7_3 is_a: CHEBI:35238 ! amino acid zwitterion [Term] id: CHEBI:87947 name: 9-ribosyl-trans-zeatin 5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87950 name: 9-ribosyl-trans-zeatin 5'-diphosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:87953 name: 9-ribosyl-trans-zeatin 5'-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:8798 name: 4a,5-dihydroriboflavin subset: chebi_ph7_3 is_a: CHEBI:15031 ! dihydroriboflavins [Term] id: CHEBI:87990 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:87992 name: beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:87994 name: alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:87996 name: 3-(m-hydroxyphenyl)propanoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:87997 name: 3-aminobutyrate is_a: CHEBI:63471 ! branched-chain amino-acid anion [Term] id: CHEBI:88003 name: fructose 6-phosphate is_a: CHEBI:24971 ! ketohexose monophosphate [Term] id: CHEBI:88004 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide [Term] id: CHEBI:88005 name: 3-phosphoglycerate(2-) is_a: CHEBI:132960 ! 3-phosphoglycerate is_a: CHEBI:61304 ! phosphoglycerate [Term] id: CHEBI:88007 name: 3-oxooleoyl-CoA is_a: CHEBI:137599 ! long-chain 3-oxo-fatty acyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA [Term] id: CHEBI:88008 name: (7Z)-hexadecenoyl-CoA is_a: CHEBI:24549 ! hexadecenoyl-CoA [Term] id: CHEBI:88015 name: archaeal dolichol subset: chebi_ph7_3 is_a: CHEBI:24913 ! isoprenoid is_a: CHEBI:26199 ! polyprenol [Term] id: CHEBI:88021 name: archaeal dolichyl N-acetyl-alpha-D-glucosaminyl phosphate(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88026 name: archaeal dolichyl 3-O-(2,3-diacetamido-2,3-dideoxy- beta-D-glucuronsyl)-N-acetyl- alpha-D-glucosaminyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88041 name: CDP-3,6-dideoxy-alpha-D-mannose(2-) subset: chebi_ph7_3 is_a: CHEBI:58078 ! CDP-3,6-dideoxy-D-mannose(2-) [Term] id: CHEBI:88042 name: UDP-beta-L-iduronate(3-) subset: chebi_ph7_3 is_a: CHEBI:58233 ! UDP-L-iduronate(3-) [Term] id: CHEBI:88048 name: cyanotoxin is_a: CHEBI:27026 ! toxin is_a: CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88052 name: prenyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88053 name: phosphatidyl-myo-inositol 6-acylmannoside(1-) subset: chebi_ph7_3 is_a: CHEBI:62643 ! anionic phospholipid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88054 name: [5-(ammoniomethyl)-3-furyl]methyl diphosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88055 name: (4-\{4-[2-(gamma-L-glutamylamino)ethyl]phenoxymethyl}furan-2-yl)methanamine(1+) subset: chebi_ph7_3 is_a: CHEBI:33719 ! alpha-amino-acid cation [Term] id: CHEBI:88056 name: ganglioside GM1/1b(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88057 name: ganglioside GD1(2-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88058 name: ganglioside GT1(3-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88059 name: ganglioside GQ1(4-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88060 name: ganglioside GP1(5-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88061 name: polyamine is_a: CHEBI:50047 ! organic amino compound [Term] id: CHEBI:88064 name: (24E)-3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl-CoA is_a: CHEBI:52135 ! steroidal acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88065 name: (24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA is_a: CHEBI:23197 ! cholestanoyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88066 name: dioctanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:88067 name: (2E,5Z)-tetradecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:88068 name: monosialomonoglycosylceramide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88069 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide [Term] id: CHEBI:88070 name: monooctanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:87657 ! octanoate ester [Term] id: CHEBI:88071 name: monosialodiglycosylceramide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88072 name: (3S,5Z)-3-hydroxytetradec-5-enoyl-CoA is_a: CHEBI:15456 ! (R)-3-hydroxyacyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:61902 ! hydroxy fatty acyl-CoA [Term] id: CHEBI:88073 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:142582 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88075 name: trisialodiglycosylceramide(3-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88076 name: monosialotriglycosylceramide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88077 name: disialotriglycosylceramide(2-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88078 name: trisialotriglycosylceramide(3-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88079 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:142594 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88080 name: (5Z)-3-oxotetradecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:88081 name: fatty acid anion 23:0 is_a: CHEBI:58953 ! saturated fatty acid anion [Term] id: CHEBI:88083 name: (3E)-tetradecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:88084 name: (2E,4E)-tetradecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA is_a: CHEBI:85556 ! trans,trans-2,4-dienoyl-CoA [Term] id: CHEBI:88086 name: (2E,7Z)-hexadecadienoyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:88087 name: (3S,7Z)-3-hydroxyhexadecenoyl-CoA is_a: CHEBI:137639 ! long-chain (3S)-hydroxy fatty acyl-CoA is_a: CHEBI:51006 ! unsaturated fatty acyl-CoA [Term] id: CHEBI:88088 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:142607 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) is_a: CHEBI:146022 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminide(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88089 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-[alpha-Neu5Ac-(2->6)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:142626 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(2-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88090 name: (7Z)-3-oxohexadecenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:15489 ! 3-oxo-fatty acyl-CoA is_a: CHEBI:33184 ! long-chain fatty acyl-CoA [Term] id: CHEBI:88091 name: 6-deoxy-6-sulfoglucono-1,5-lactone(1-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion [Term] id: CHEBI:88093 name: 6-deoxy-6-sulfo-D-gluconate(2-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:88094 name: 2-dehydro-3,6-dideoxy-6-sulfo-D-gluconate(2-) subset: chebi_ph7_3 is_a: CHEBI:33554 ! organosulfonate oxoanion is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:88095 name: N-hexanoylphytosphingosine subset: chebi_ph7_3 is_a: CHEBI:139051 ! phytoceramide [Term] id: CHEBI:88096 name: N-hexanoylphytosphingosine 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:133525 ! N-acylphytosphingosine 1-phosphate(2-) [Term] id: CHEBI:88097 name: 7alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88098 name: 3beta,12alpha-dihydroxy-5beta-cholan-24-oic acid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88099 name: D-3-sulfolactaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:77135 ! 3-sulfolactaldehyde(1-) [Term] id: CHEBI:88102 name: 3beta,7alpha-dihydroxy-5beta-cholan-24-oic acid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88104 name: 12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36260 ! monohydroxy-5beta-cholanic acid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88105 name: 3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid is_a: CHEBI:27114 ! trihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36836 ! 3beta-hydroxy steroid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88107 name: geranyl phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88108 name: 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oic acid is_a: CHEBI:1624 ! 3-oxo-5beta-steroid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:36846 ! 12alpha-hydroxy steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88109 name: 7alpha-hydroxy-3-oxochol-4-en-24-oic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:36843 ! 7alpha-hydroxy steroid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid is_a: CHEBI:49273 ! cholenoic acid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:88112 name: 3-oxochola-4,6-dien-24-oic acid is_a: CHEBI:3098 ! bile acid is_a: CHEBI:47909 ! 3-oxo-Delta(4) steroid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88115 name: N(2)-L-glutamino(1-) group subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue is_a: CHEBI:90782 ! C-terminal proteinogenic amino-acid residue(1-) [Term] id: CHEBI:88117 name: 2-ethylhexyl sulfate is_a: CHEBI:29281 ! alkyl sulfate relationship: has_role CHEBI:35195 ! surfactant relationship: has_role CHEBI:50903 ! carcinogenic agent [Term] id: CHEBI:88118 name: 2,3-epoxy-2,3-dihydrobenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:88119 name: dTDP-2,3-dehydro-2,6-dideoxy-4-keto-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:88123 name: (R)-12-hydroxysqualene subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:36615 ! triterpenoid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88133 name: D-ribitol 1-phosphate is_a: CHEBI:22292 ! alditol 1-phosphate is_a: CHEBI:26554 ! ribitol phosphate [Term] id: CHEBI:88135 name: N-acetylmethionine sulfone is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:35850 ! sulfone is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:88136 name: N-acetyl-L-methionine sulfoximine is_a: CHEBI:21545 ! N-acetyl-L-amino acid is_a: CHEBI:38084 ! sulfoximide is_a: CHEBI:48927 ! N-acyl-L-alpha-amino acid is_a: CHEBI:84121 ! L-methionine derivative [Term] id: CHEBI:88137 name: 2-hydro-beta-NADP(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88138 name: 2-hydro-beta-NAD(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88139 name: 6-hydro-beta-NADP(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88140 name: 6-hydro-beta-NAD(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88141 name: 2''-O-glutaryl-ADP-D-ribose is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:88143 name: (3,4-dimethoxyphenyl)methyloxidanyl subset: chebi_ph7_3 is_a: CHEBI:36872 ! organic radical [Term] id: CHEBI:88145 name: 2''-O-succinyl-ADP-D-ribose is_a: CHEBI:138979 ! hemisuccinate is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:88146 name: 2''-O-malonyl-ADP-D-ribose is_a: CHEBI:25609 ! nucleotide-sugar [Term] id: CHEBI:88147 name: 2,5-dihydroxybenzoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:88148 name: 2,3-saturated fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:65111 ! 3-substituted propionyl-CoA(4-) is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:88149 name: (S)-4-hydroxy-1-pyrroline-2-carboxylic acid is_a: CHEBI:16352 ! 4-hydroxy-1-pyrroline-2-carboxylic acid [Term] id: CHEBI:88152 name: 2-O-[alpha-D-mannosyl-(1->2)-alpha-D-glucosyl]-D-glyceric acid is_a: CHEBI:24400 ! glycoside is_a: CHEBI:61355 ! 3-hydroxy carboxylic acid is_a: CHEBI:63353 ! disaccharide derivative relationship: has_role CHEBI:76507 ! marine metabolite relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88153 name: tripropionin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride is_a: CHEBI:36243 ! propanoate ester relationship: has_role CHEBI:35617 ! flavouring agent [Term] id: CHEBI:88154 name: alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide subset: chebi_ph7_3 is_a: CHEBI:36508 ! glycotriaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:88155 name: dipropionin subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride is_a: CHEBI:30879 ! alcohol is_a: CHEBI:36243 ! propanoate ester is_a: CHEBI:51307 ! diester [Term] id: CHEBI:88156 name: diacetin subset: chebi_ph7_3 is_a: CHEBI:18035 ! diglyceride is_a: CHEBI:30879 ! alcohol is_a: CHEBI:47622 ! acetate ester is_a: CHEBI:51307 ! diester [Term] id: CHEBI:88157 name: cis-3-hydroxy-D-proline is_a: CHEBI:64368 ! 3-hydroxyproline is_a: CHEBI:84185 ! D-proline derivative relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:88158 name: 1,4-naphthoquinone-2-carboxylic acid is_a: CHEBI:132142 ! 1,4-naphthoquinones is_a: CHEBI:35951 ! dioxo monocarboxylic acid [Term] id: CHEBI:88159 name: 3-hydroxy-O,5-dimethyl-L-tyrosine is_a: CHEBI:27177 ! L-tyrosine derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88164 name: 3-chloroalanine is_a: CHEBI:23127 ! chloroalanine is_a: CHEBI:36683 ! organochlorine compound is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:88166 name: (S)-2-methylbutanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:57336 ! 2-methylbutanoyl-CoA(4-) [Term] id: CHEBI:88167 name: N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:88184 name: metal allergen is_a: CHEBI:33521 ! metal atom relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:88186 name: metal cation allergen is_a: CHEBI:25213 ! metal cation relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:88187 name: penicillin allergen is_a: CHEBI:17334 ! penicillin relationship: has_role CHEBI:50904 ! allergen [Term] id: CHEBI:88188 name: drug allergen is_a: CHEBI:23888 ! drug is_a: CHEBI:50904 ! allergen [Term] id: CHEBI:88190 name: 2-oxido-5-methylquinone subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:88221 name: N(omega),N('omega)-dimethyl-L-arginine(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:88222 name: N(5)-methyl-argininium(1+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:88226 name: (2E,6E)-farnesyl monophosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:88228 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(4-) subset: chebi_ph7_3 is_a: CHEBI:78455 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1)(4-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88229 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(3-) subset: chebi_ph7_3 is_a: CHEBI:78452 ! alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(3-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88230 name: autophagy inhibitor is_a: CHEBI:35222 ! inhibitor is_a: CHEBI:52206 ! biochemical role [Term] id: CHEBI:88231 name: beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside is_a: CHEBI:87785 ! beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(2-) [Term] id: CHEBI:88232 name: epoxypheophorbide a(2-) is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:88233 name: epoxypheophorbide a(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:88234 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(2-) subset: chebi_ph7_3 is_a: CHEBI:78436 ! ganglioside GD3(2-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88235 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(1-) subset: chebi_ph7_3 is_a: CHEBI:60065 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(1-) is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:88237 name: CDP-3,6-dideoxy-alpha-D-mannose is_a: CHEBI:17259 ! CDP-3,6-dideoxy-D-mannose [Term] id: CHEBI:88238 name: (5Z,9Z,12Z)-octadecatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88239 name: (5Z,9Z,12Z,15Z)-octadecatetraenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88240 name: oleoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88241 name: (9Z,12E)-octadecadienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88242 name: (9Z,12Z)-octadeca-9,12-dien-6-ynoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88243 name: UDP-beta-L-iduronic acid is_a: CHEBI:17683 ! UDP-L-iduronic acid [Term] id: CHEBI:88244 name: (9Z,12Z,15Z)-octadeca-9,12,15-trien-6-ynoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88245 name: prenyl phosphate is_a: CHEBI:26250 ! prenol phosphate [Term] id: CHEBI:88247 name: [5-(aminomethyl)-3-furyl]methyl diphosphate is_a: CHEBI:24129 ! furans is_a: CHEBI:50994 ! primary amino compound is_a: CHEBI:62889 ! organic diphosphate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88248 name: (4-\{4-[2-(gamma-L-glutamylamino)ethyl]phenoxymethyl}furan-2-yl)methanamine is_a: CHEBI:24129 ! furans is_a: CHEBI:24317 ! L-glutamine derivative is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:88250 name: 6-deoxy-6-sulfoglucono-1,5-lactone is_a: CHEBI:38029 ! carbohydrate sulfonate is_a: CHEBI:74105 ! aldono-1,5-lactone relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:88251 name: (9Z,11E,13E,15Z)-octadecatetraenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88252 name: (11Z,14Z)-icosadienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88253 name: (11Z,14Z,17Z)-icosatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88254 name: (9Z,11E,13E)-octadecatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88257 name: (8E,10E,12Z)-octadecatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88259 name: (9Z,11E,13Z)-octadeca-9,11,13-trienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88260 name: (9Z)-octadec-9-en-12-ynoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88261 name: palmitoleoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88262 name: (9Z,12E)-hexadecadienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88264 name: (7Z,10Z,13Z,16Z)-docosatetraenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:149498 ! (7Z,10Z,13Z,16Z)-docosatetraenoyl derivative is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88265 name: (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:149502 ! (4Z,7Z,10Z,13Z,16Z)-docosapentaenoyl derivative is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88266 name: (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:149499 ! (7Z,10Z,13Z,16Z,19Z)-docosapentaenoyl derivative is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88267 name: (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:149500 ! (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl derivative is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88268 name: (7Z,10Z)-hexadecadienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88269 name: (7Z,10Z,13Z)-hexadecatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88270 name: 6-deoxy-6-sulfo-D-gluconic acid is_a: CHEBI:38029 ! carbohydrate sulfonate is_a: CHEBI:63436 ! carbohydrate acid derivative relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:88277 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36543 ! sialotetraosylceramide [Term] id: CHEBI:88278 name: N-acetylhexosaminyl-dihexosylceramide is_a: CHEBI:36508 ! glycotriaosylceramide [Term] id: CHEBI:88291 name: hydroxyimidazole is_a: CHEBI:24780 ! imidazoles is_a: CHEBI:74818 ! heteroaryl hydroxy compound [Term] id: CHEBI:88306 name: 4-nitrophenols is_a: CHEBI:39362 ! mononitrophenol [Term] id: CHEBI:88332 name: aralkylammonium subset: chebi_ph7_3 is_a: CHEBI:65296 ! primary ammonium ion [Term] id: CHEBI:88347 name: 15(S)-HEPE is_a: CHEBI:72627 ! 15-HEPE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:88350 name: 2-phosphoglycerate(3-) subset: chebi_ph7_3 is_a: CHEBI:61304 ! phosphoglycerate relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:88351 name: linoleoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:88360 name: N-(1-naphthyl)carboxamide subset: chebi_ph7_3 is_a: CHEBI:88361 ! N-(naphthyl)carboxamide [Term] id: CHEBI:88361 name: N-(naphthyl)carboxamide is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:25477 ! naphthalenes is_a: CHEBI:62733 ! aromatic amide [Term] id: CHEBI:88390 name: 1-hydroxybutan-2-one subset: chebi_ph7_3 is_a: CHEBI:139590 ! primary alpha-hydroxy ketone [Term] id: CHEBI:88414 name: (S)-2-methylbutanal subset: chebi_ph7_3 is_a: CHEBI:16182 ! 2-methylbutanal [Term] id: CHEBI:88456 name: 8,15-DiHETE is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid [Term] id: CHEBI:88457 name: 14,15-EpETE is_a: CHEBI:61498 ! epoxy fatty acid [Term] id: CHEBI:88494 name: epsilon-(gamma-glutamyl)lysine is_a: CHEBI:16232 ! N(6)-acyl-L-lysine [Term] id: CHEBI:88514 name: butyl formate subset: chebi_ph7_3 is_a: CHEBI:52343 ! formate ester relationship: has_role CHEBI:35617 ! flavouring agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:48358 ! polar aprotic solvent [Term] id: CHEBI:88528 name: hexanal subset: chebi_ph7_3 is_a: CHEBI:12834 ! n-alkanal is_a: CHEBI:133249 ! saturated fatty aldehyde is_a: CHEBI:142621 ! medium-chain fatty aldehyde relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:88609 name: (E)-2-dodecene subset: chebi_ph7_3 is_a: CHEBI:167555 ! 2-dodecene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:8871 name: risperidone is_a: CHEBI:37143 ! organofluorine compound is_a: CHEBI:38932 ! pyridopyrimidine is_a: CHEBI:48585 ! heteroarylpiperidine is_a: CHEBI:51545 ! 1,2-benzoxazoles relationship: has_role CHEBI:35471 ! psychotropic drug relationship: has_role CHEBI:37890 ! alpha-adrenergic antagonist relationship: has_role CHEBI:37955 ! H1-receptor antagonist relationship: has_role CHEBI:48279 ! serotonergic antagonist relationship: has_role CHEBI:48561 ! dopaminergic antagonist relationship: has_role CHEBI:65191 ! second generation antipsychotic relationship: has_role CHEBI:76779 ! EC 3.4.21.26 (prolyl oligopeptidase) inhibitor [Term] id: CHEBI:88752 name: cholesteryl (5Z,8Z,11Z)-icosatrienoate subset: chebi_ph7_3 is_a: CHEBI:138331 ! cholesteryl icosatrienoate relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:88756 name: cholesteryl gamma-linolenate subset: chebi_ph7_3 is_a: CHEBI:132004 ! cholesteryl octadecatrienoate relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:88764 name: ethyl butyrate subset: chebi_ph7_3 is_a: CHEBI:50477 ! butyrate ester relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:88824 name: N-acetylcadaverine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:22160 ! acetamides is_a: CHEBI:50442 ! N-substituted cadaverine is_a: CHEBI:50994 ! primary amino compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:89 name: (-)-camphene subset: chebi_ph7_3 is_a: CHEBI:3830 ! camphene [Term] id: CHEBI:89268 name: 2-hydroxyestradiol 3-methyl ether subset: chebi_ph7_3 is_a: CHEBI:131621 ! C19-steroid is_a: CHEBI:35343 ! 17beta-hydroxy steroid is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:36857 ! 2-hydroxy steroid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:8927 name: S-(2,4-dinitrophenyl)glutathione is_a: CHEBI:24335 ! glutathione conjugate [Term] id: CHEBI:8934 name: (4-bromophenylsulfanyl)pyruvic acid is_a: CHEBI:35683 ! aryl sulfide is_a: CHEBI:35910 ! 2-oxo monocarboxylic acid is_a: CHEBI:37141 ! organobromine compound [Term] id: CHEBI:89417 name: 5alpha-dihydrotestosterone 17-O-(beta-D-glucuronide) is_a: CHEBI:13601 ! 3-oxo-5alpha-steroid is_a: CHEBI:26763 ! steroid glucosiduronic acid relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:8944 name: S-adenosyl-4-methylthio-2-oxobutanoic acid is_a: CHEBI:25697 ! organic cation is_a: CHEBI:26830 ! sulfonium compound relationship: has_role CHEBI:76971 ! Escherichia coli metabolite [Term] id: CHEBI:89484 name: 4-heptanone subset: chebi_ph7_3 is_a: CHEBI:18044 ! dialkyl ketone relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:89540 name: methyl propenyl ketone subset: chebi_ph7_3 is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:61908 ! EC 1.14.13.39 (nitric oxide synthase) inhibitor relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:89656 name: Leu-enkephalin is_a: CHEBI:48545 ! pentapeptide relationship: has_role CHEBI:25512 ! neurotransmitter relationship: has_role CHEBI:35480 ! analgesic relationship: has_role CHEBI:55322 ! mu-opioid receptor agonist relationship: has_role CHEBI:64054 ! delta-opioid receptor agonist relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:89719 name: propyl butyrate subset: chebi_ph7_3 is_a: CHEBI:50477 ! butyrate ester relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:89823 name: PS(16:0/18:2(9Z,12Z)) is_a: CHEBI:18303 ! phosphatidyl-L-serine [Term] id: CHEBI:89828 name: propyl propionate subset: chebi_ph7_3 is_a: CHEBI:36243 ! propanoate ester relationship: has_role CHEBI:59163 ! biomarker relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:89891 name: 3-hexanone subset: chebi_ph7_3 is_a: CHEBI:18044 ! dialkyl ketone relationship: has_role CHEBI:24850 ! insect attractant relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:89929 name: glycoursodeoxycholic acid is_a: CHEBI:16180 ! N-acylglycine is_a: CHEBI:36255 ! bile acid glycine conjugate relationship: has_role CHEBI:63726 ! neuroprotective agent relationship: has_role CHEBI:85234 ! human blood serum metabolite [Term] id: CHEBI:90029 name: PS(16:0/20:4(5Z,8Z,11Z,14Z)) is_a: CHEBI:18303 ! phosphatidyl-L-serine [Term] id: CHEBI:9003 name: salicin 6-phosphate is_a: CHEBI:37549 ! glycoside phosphate [Term] id: CHEBI:90076 name: (8Z,11Z,14Z)-icosatrienoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90077 name: arachidonoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90078 name: alpha-linolenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90079 name: (6Z,9Z,12Z,15Z)-octadecatetraenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90081 name: gamma-linolenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90082 name: omega-3-arachidonoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90083 name: (5Z,8Z,11Z,14Z,17Z)-icosapentaenoyl-containing glycerolipid subset: chebi_ph7_3 is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90085 name: N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:36508 ! glycotriaosylceramide [Term] id: CHEBI:90086 name: N-benzoyl-L-arginine is_a: CHEBI:21645 ! N-acyl-L-arginine is_a: CHEBI:22702 ! benzamides [Term] id: CHEBI:90092 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36542 ! sialopentaosylceramide [Term] id: CHEBI:90093 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-[alpha-Neu5Ac-(2->6)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer is_a: CHEBI:36542 ! sialopentaosylceramide [Term] id: CHEBI:90095 name: 2-dehydro-3,6-dideoxy-6-sulfo-D-gluconic acid is_a: CHEBI:38029 ! carbohydrate sulfonate is_a: CHEBI:63436 ! carbohydrate acid derivative relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90099 name: carboxyphosphoric acid is_a: CHEBI:25703 ! organic phosphate is_a: CHEBI:37787 ! acyclic mixed acid anhydride is_a: CHEBI:64708 ! one-carbon compound [Term] id: CHEBI:90104 name: D-3-sulfolactaldehyde is_a: CHEBI:77265 ! 3-sulfolactaldehyde relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90109 name: L-3-sulfolactaldehyde(1-) subset: chebi_ph7_3 is_a: CHEBI:77135 ! 3-sulfolactaldehyde(1-) [Term] id: CHEBI:90118 name: tricosanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:77332 ! saturated fatty acyl-CoA(4-) [Term] id: CHEBI:90119 name: (2E)-tricosenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:138261 ! very long-chain fatty acyl-CoA(4-) is_a: CHEBI:58856 ! 2,3-trans-enoyl CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) [Term] id: CHEBI:90143 name: N-amidinoaspartic acid is_a: CHEBI:22661 ! aspartic acid derivative is_a: CHEBI:24436 ! guanidines is_a: CHEBI:35692 ! dicarboxylic acid [Term] id: CHEBI:90151 name: alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:88056 ! ganglioside GM1/1b(1-) [Term] id: CHEBI:90153 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0)(2-) subset: chebi_ph7_3 is_a: CHEBI:78445 ! alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(2-) [Term] id: CHEBI:90156 name: 2-methylhexanoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) [Term] id: CHEBI:90157 name: 2-methylhexenoyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:183508 ! methyl-branched fatty acyl-CoA(4-) is_a: CHEBI:77331 ! monounsaturated fatty acyl-CoA(4-) is_a: CHEBI:88148 ! 2,3-saturated fatty acyl-CoA(4-) is_a: CHEBI:90546 ! medium-chain fatty acyl-CoA(4-) [Term] id: CHEBI:90158 name: N-carbamoylaspartate(2-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:90159 name: geranyl phosphate is_a: CHEBI:16460 ! polyprenol phosphate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90162 name: 2,3-epoxy-2,3-dihydrobenzoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:90163 name: beta-D-3-sulfogalactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:84733 ! dihexosylceramide sulfate(1-) [Term] id: CHEBI:90164 name: N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-3-sulfogalactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide(1-) subset: chebi_ph7_3 is_a: CHEBI:167097 ! trihexosylceramide sulfate is_a: CHEBI:58958 ! organosulfate oxoanion [Term] id: CHEBI:90165 name: N-hexanoylphytosphingosine 1-phosphate is_a: CHEBI:134540 ! N-acylphytosphingosine 1-phosphate [Term] id: CHEBI:90167 name: dTDP-2,3-dehydro-2,6-dideoxy-4-keto-alpha-D-glucose is_a: CHEBI:23557 ! dTDP-sugar [Term] id: CHEBI:90170 name: 2-hydro-beta-NADP is_a: CHEBI:13392 ! NAD(P)H is_a: CHEBI:25523 ! NADP [Term] id: CHEBI:90171 name: 2-hydro-beta-NAD is_a: CHEBI:13389 ! NAD is_a: CHEBI:13392 ! NAD(P)H [Term] id: CHEBI:90172 name: c-Jun N-terminal kinase inhibitor is_a: CHEBI:79091 ! EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor [Term] id: CHEBI:90173 name: 6-hydro-beta-NADP is_a: CHEBI:13392 ! NAD(P)H is_a: CHEBI:25523 ! NADP [Term] id: CHEBI:90174 name: 6-hydro-beta-NAD is_a: CHEBI:13389 ! NAD is_a: CHEBI:13392 ! NAD(P)H [Term] id: CHEBI:90176 name: 2,5-dihydroxybenzoyl-CoA is_a: CHEBI:17984 ! acyl-CoA [Term] id: CHEBI:90189 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GlcNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90218 name: gentamycin(2+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation is_a: CHEBI:35274 ! ammonium ion derivative [Term] id: CHEBI:90219 name: gentamycin 2''-phosphate dizwitterion subset: chebi_ph7_3 is_a: CHEBI:27369 ! zwitterion [Term] id: CHEBI:90222 name: (S)-2-methylbutanoyl-CoA is_a: CHEBI:15451 ! (2S)-2-methylacyl-CoA is_a: CHEBI:15477 ! 2-methylbutanoyl-CoA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:90224 name: 2-methylhexanoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA [Term] id: CHEBI:90228 name: epoxypheophorbide a is_a: CHEBI:32955 ! epoxide is_a: CHEBI:38254 ! pheophorbide [Term] id: CHEBI:90230 name: prostaglandin E2 1-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:134396 ! secondary allylic alcohol is_a: CHEBI:26338 ! prostaglandins E is_a: CHEBI:33573 ! tetrol is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:36132 ! alicyclic ketone relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90231 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0) is_a: CHEBI:27515 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-D-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer [Term] id: CHEBI:90233 name: prostaglandin F2alpha 1-glyceryl ester subset: chebi_ph7_3 is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35759 ! 1-monoglyceride is_a: CHEBI:36066 ! prostaglandins Falpha is_a: CHEBI:37205 ! pentol is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90236 name: (2E,6E)-farnesyl monophosphate is_a: CHEBI:24018 ! farnesyl phosphate relationship: has_role CHEBI:70782 ! PPARalpha agonist relationship: has_role CHEBI:73730 ! PPARbeta/delta agonist relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:90238 name: beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0) is_a: CHEBI:28175 ! beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer [Term] id: CHEBI:90240 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(d18:1/18:0) is_a: CHEBI:79213 ! alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide [Term] id: CHEBI:90246 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-[alpha-Neu5Ac-(2->6)]-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-Cer(2-) subset: chebi_ph7_3 is_a: CHEBI:88057 ! ganglioside GD1(2-) [Term] id: CHEBI:90262 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide [Term] id: CHEBI:90264 name: L-3-sulfolactaldehyde is_a: CHEBI:77265 ! 3-sulfolactaldehyde [Term] id: CHEBI:90265 name: alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90266 name: tricosanoyl-CoA is_a: CHEBI:61910 ! very long-chain fatty acyl-CoA [Term] id: CHEBI:90277 name: (2E)-tricosenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:143017 ! ultra-long-chain fatty acyl-CoA is_a: CHEBI:15469 ! alk-2-enoyl-CoA is_a: CHEBI:50998 ! trans-2-enoyl-CoA [Term] id: CHEBI:90292 name: beta-D-Gal-(1->3)-[alpha-L-Fuc-(1->4)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:90811 ! beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide [Term] id: CHEBI:90307 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:90358 ! beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer [Term] id: CHEBI:90310 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-monoacyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:63428 ! digalactosylglycerol derivative [Term] id: CHEBI:90318 name: EC 6.4.1.1 (pyruvate carboxylase) inhibitor is_a: CHEBI:76824 ! EC 6.4.1.* (carboxylase) inhibitor [Term] id: CHEBI:90335 name: alpha-N-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90336 name: alpha-N-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90337 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-didodecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90339 name: alpha-N-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90340 name: 1,2-didodecanoyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90342 name: 2,3-di-O-dodecanoyl-1-O-beta-D-galactopyranosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:61799 ! beta-D-galactopyranosyl diglyceride [Term] id: CHEBI:90356 name: dibenzothiophene sulfone subset: chebi_ph7_3 is_a: CHEBI:23684 ! dibenzothiophenes is_a: CHEBI:35850 ! sulfone [Term] id: CHEBI:90357 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer subset: chebi_ph7_3 is_a: CHEBI:36642 ! glycohexaosylceramide [Term] id: CHEBI:90358 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer subset: chebi_ph7_3 is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36640 ! glycoheptaosylceramide [Term] id: CHEBI:90359 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-monododecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:9036 name: sarpagine subset: chebi_ph7_3 is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:33853 ! phenols is_a: CHEBI:38958 ! indole alkaloid is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:50996 ! tertiary amino compound [Term] id: CHEBI:90360 name: beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36640 ! glycoheptaosylceramide [Term] id: CHEBI:90362 name: 2-methylhexenoyl-CoA is_a: CHEBI:139575 ! monounsaturated fatty acyl-CoA is_a: CHEBI:19573 ! 2-enoyl-CoA is_a: CHEBI:25271 ! methyl-branched fatty acyl-CoA is_a: CHEBI:61907 ! medium-chain fatty acyl-CoA relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90376 name: beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide [Term] id: CHEBI:90379 name: beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide [Term] id: CHEBI:90380 name: alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide [Term] id: CHEBI:90381 name: alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide is_a: CHEBI:36642 ! glycohexaosylceramide [Term] id: CHEBI:90383 name: alpha-Neu5Gc-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90384 name: alpha-Neu5Gc-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90390 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90392 name: alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90396 name: (3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one is_a: CHEBI:22707 ! benzenetriol is_a: CHEBI:23697 ! dichlorobenzene is_a: CHEBI:76224 ! aromatic ketone relationship: has_role CHEBI:75763 ! eukaryotic metabolite [Term] id: CHEBI:90397 name: 1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:90398 name: (3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one(1-) subset: chebi_ph7_3 is_a: CHEBI:50525 ! phenolate anion [Term] id: CHEBI:904 name: 2,4-diaminopentanoic acid is_a: CHEBI:35987 ! diamino acid is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid [Term] id: CHEBI:90400 name: alpha-D-GalNAc-(1->3)-beta-D-GalNAc-(1->3)-alpha-D-Gal-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:61360 ! globoside [Term] id: CHEBI:90409 name: 5-hydroxymethyluridine-2'-deoxy-5'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:50860 ! organic molecular entity is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:90418 name: N(6)-D-ribulosyl-L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:90420 name: N(6)-(3-O-phospho-D-ribulosyl)-L-lysinium residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:90430 name: phosphatidylinositol(16:0/20:4) is_a: CHEBI:136235 ! phosphatidylinositol 36:4 [Term] id: CHEBI:90431 name: phosphatidylinositol(18:0/18:2) is_a: CHEBI:136236 ! phosphatidylinositol 36:2 [Term] id: CHEBI:90432 name: phosphatidylinositol(18:0/20:4) is_a: CHEBI:136239 ! phosphatidylinositol 38:4 is_a: CHEBI:28874 ! phosphatidylinositol [Term] id: CHEBI:90433 name: phosphatidylserine(18:0/18:1) is_a: CHEBI:136256 ! phosphatidylserine 36:1 [Term] id: CHEBI:90434 name: phosphatidylserine(18:0/18:2) is_a: CHEBI:136257 ! phosphatidylserine 36:2 [Term] id: CHEBI:90437 name: phosphatidylserine(18:1/18:1) is_a: CHEBI:136257 ! phosphatidylserine 36:2 [Term] id: CHEBI:90452 name: lysophosphatidylethanolamine 16:0 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90453 name: 1,2-dioctanoyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:167094 ! medium-chain 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90456 name: lysophosphatidylinositol 18:1 is_a: CHEBI:64931 ! lysophosphatidyl-1D-myo-inositol [Term] id: CHEBI:90457 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-dioctoanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90463 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-1,2-bis(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90469 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-2-mono(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90475 name: 3-(beta-D-galactosyl)-2-mono(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:90477 name: 3-(beta-D-galactosyl)-1,2-bis(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90481 name: 2-octanoyl-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:90769 ! 3-(beta-D-galactosyl)monooctanoyl-sn-glycerol [Term] id: CHEBI:90493 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-2-octoanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90499 name: (7Z,10Z,13Z)-hexadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:90582 ! hexadecatrienoate [Term] id: CHEBI:90501 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(3-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90506 name: 1,2-di-(9Z,12Z-octadecadienoyl)-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90507 name: 1-(9Z-octadecenoyl)-2-hexadecanoyl-3-beta-D-galactosyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90510 name: S-[(2E,6E)-farnesyl]-L-cysteinate residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:90511 name: S-[(2E,6E)-farnesyl]-L-cysteine methyl ester residue subset: chebi_ph7_3 is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:90512 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-Cer(5-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90513 name: alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-Cer(4-) subset: chebi_ph7_3 is_a: CHEBI:88059 ! ganglioside GQ1(4-) [Term] id: CHEBI:90514 name: 1-(beta-D-galactosyl)-monododecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:157759 ! glycosylmonoacylglycerol is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:90515 name: 3-(beta-D-galactosyl)-monododecanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid [Term] id: CHEBI:90516 name: L-leucinate residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:90517 name: methyl L-leucinato group subset: chebi_ph7_3 is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:9053 name: sclareol subset: chebi_ph7_3 is_a: CHEBI:36770 ! labdane diterpenoid relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48318 ! fragrance relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:90546 name: medium-chain fatty acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:77636 ! fatty acyl-CoA(4-) [Term] id: CHEBI:90549 name: 1-monohexosyl-2,3-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:90550 ! monohexosyldiglyceride [Term] id: CHEBI:90550 name: monohexosyldiglyceride subset: chebi_ph7_3 is_a: CHEBI:166904 ! glycosyldiradylglycerol is_a: CHEBI:33308 ! carboxylic ester is_a: CHEBI:90551 ! monohexosyldiradylglycerol [Term] id: CHEBI:90551 name: monohexosyldiradylglycerol subset: chebi_ph7_3 is_a: CHEBI:166904 ! glycosyldiradylglycerol is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90553 name: 1-dihexosyl-2,3-diacylglycerol subset: chebi_ph7_3 is_a: CHEBI:90575 ! dihexosyldiglyceride [Term] id: CHEBI:90575 name: dihexosyldiglyceride subset: chebi_ph7_3 is_a: CHEBI:166904 ! glycosyldiradylglycerol is_a: CHEBI:90576 ! dihexosyldiradylglycerol [Term] id: CHEBI:90576 name: dihexosyldiradylglycerol subset: chebi_ph7_3 is_a: CHEBI:35741 ! glycerolipid [Term] id: CHEBI:90577 name: 1-(9S,13S,12-oxophytodienoyl)-2-(7Z,10Z,13Z)-hexadecatrienoyl-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:17615 ! 1,2-diacyl-3-beta-D-galactosyl-sn-glycerol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:90578 name: 2-(7Z,10Z,13Z)-hexadecatrienoyl-3-(beta-D-galactosyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:18063 ! 2-O-acyl-3-O-beta-D-galactosyl-sn-glycerol [Term] id: CHEBI:90582 name: hexadecatrienoate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90595 name: S-[(2E,6E)-farnesyl]-L-cysteino group is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90596 name: L-beta-isoaspartate residue subset: chebi_ph7_3 is_a: CHEBI:64898 ! anionic amino-acid residue [Term] id: CHEBI:90598 name: L-isoaspartate alpha-methyl ester residue subset: chebi_ph7_3 is_a: CHEBI:33708 ! amino-acid residue [Term] id: CHEBI:90602 name: uridylyl-L-tyrosine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:90605 name: monodecanoylglycerol subset: chebi_ph7_3 is_a: CHEBI:17408 ! monoacylglycerol is_a: CHEBI:87658 ! decanoate ester [Term] id: CHEBI:90610 name: O-[S-2,3-dihydroxybenzoylpantetheine-4'-phosphoryl]-L-serine(1-) residue subset: chebi_ph7_3 is_a: CHEBI:76179 ! O-(S-acylpantetheine-4'-phosphoryl)serine(1-) residue [Term] id: CHEBI:90615 name: 2'-deoxyadenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:140284 ! deoxyribonucleotide(1-) residue [Term] id: CHEBI:90616 name: N(6)-methyl-2'-deoxyadenosine 5'-monophosphate(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:90618 name: C-terminal Gly-Gly-AMP(1-) group subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:90619 name: C-terminal N-glycylaminoethanethioic S-acid residue subset: chebi_ph7_3 is_a: CHEBI:22332 ! alkylamino group [Term] id: CHEBI:9062 name: scutellarein is_a: CHEBI:38684 ! tetrahydroxyflavone relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:90628 name: benzyl ester is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:90631 name: 5-hydroperoxy-15-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:137548 ! hydroperoxy(hydroxy)icosatetraenoate [Term] id: CHEBI:90632 name: 5(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:9066 name: L-adenosylselenomethionine is_a: CHEBI:22260 ! adenosines is_a: CHEBI:25697 ! organic cation is_a: CHEBI:26640 ! selenomethionines relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:90675 name: ribonucleotide residue(1-) subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:90676 name: 2'-O-methylribonucleotide(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:9068 name: Se-methylselenocysteine is_a: CHEBI:26632 ! selenocysteines is_a: CHEBI:83925 ! non-proteinogenic alpha-amino acid relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90680 name: 12(S)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131858 ! HETE anion is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:90688 name: metformin(1+) is_a: CHEBI:60251 ! guanidinium ion [Term] id: CHEBI:90694 name: 12(S)-HHTrE(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion [Term] id: CHEBI:90696 name: thromboxane B2(1-) subset: chebi_ph7_3 is_a: CHEBI:62945 ! thromboxane anion [Term] id: CHEBI:90697 name: 11-oxo-ETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131859 ! oxo-ETE anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90707 name: 20-hydroxylipoxin A4(1-) subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:67022 ! lipoxin anion [Term] id: CHEBI:90708 name: retinoic acid receptor modulator is_a: CHEBI:90709 ! nuclear receptor modulator [Term] id: CHEBI:90709 name: nuclear receptor modulator is_a: CHEBI:90710 ! receptor modulator [Term] id: CHEBI:90710 name: receptor modulator is_a: CHEBI:23888 ! drug [Term] id: CHEBI:90711 name: 20-hydroxylipoxin B4(1-) subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:67022 ! lipoxin anion [Term] id: CHEBI:90715 name: 5,20-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90716 name: 8-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90717 name: 8,20-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90718 name: 12-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion [Term] id: CHEBI:90719 name: 12,20-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90720 name: 20-oxoleukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:62942 ! leukotriene anion is_a: CHEBI:76309 ! omega-oxo fatty acid anion [Term] id: CHEBI:90722 name: 20-hydroxy-20-oxoleukotriene B4(2-) subset: chebi_ph7_3 is_a: CHEBI:28965 ! dicarboxylic acid dianion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:90723 name: 6-trans-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:90725 name: very long-chain 3-oxoacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:90726 ! 3-oxoacyl-CoA(4-) is_a: CHEBI:90736 ! very long-chain acyl-CoA(4-) [Term] id: CHEBI:90726 name: 3-oxoacyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:90732 name: 20-hydroxy-6-trans-leukotriene B4(1-) subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62942 ! leukotriene anion [Term] id: CHEBI:90736 name: very long-chain acyl-CoA(4-) subset: chebi_ph7_3 is_a: CHEBI:58342 ! acyl-CoA(4-) [Term] id: CHEBI:90737 name: 5-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90740 name: dihydronaphthalenes is_a: CHEBI:36785 ! carbobicyclic compound [Term] id: CHEBI:90749 name: antidote to cyanide poisoning is_a: CHEBI:50247 ! antidote [Term] id: CHEBI:90761 name: 2-deoxy-D-ribofuranose subset: chebi_ph7_3 is_a: CHEBI:23635 ! deoxypentose relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90762 name: N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanine(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:90763 name: N-acetyl-D-glucosaminyl-(1->4)-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysine(2-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:90768 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-monooctanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90769 name: 3-(beta-D-galactosyl)monooctanoyl-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:90770 name: 3-(beta-D-galactosyl)mono(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24145 ! galactoglycerolipid is_a: CHEBI:63367 ! monosaccharide derivative [Term] id: CHEBI:90772 name: 12(S)-HpEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131876 ! hydroperoxyicosapentaenoate is_a: CHEBI:78078 ! 12-HPEPE(1-) [Term] id: CHEBI:90774 name: 3-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-mono(long-chain acyl)-sn-glycerol subset: chebi_ph7_3 is_a: CHEBI:24385 ! glycoglycerolipid is_a: CHEBI:63353 ! disaccharide derivative [Term] id: CHEBI:90776 name: 11-oxo-ETE is_a: CHEBI:51689 ! enone is_a: CHEBI:61704 ! oxoicosatetraenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90778 name: C-terminal Gly-Gly(1-) residue subset: chebi_ph7_3 is_a: CHEBI:64775 ! organic anionic group [Term] id: CHEBI:90779 name: S-substituted glutathione(1-) subset: chebi_ph7_3 is_a: CHEBI:60334 ! peptide anion [Term] id: CHEBI:90781 name: 13-oxo-9Z,11E-ODE(1-) subset: chebi_ph7_3 is_a: CHEBI:133556 ! oxooctadecadienoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:90782 name: C-terminal proteinogenic amino-acid residue(1-) subset: chebi_ph7_3 is_a: CHEBI:143819 ! C-terminal amino acid residue(1-) is_a: CHEBI:35416 ! alpha-amino-acid residue anion [Term] id: CHEBI:90783 name: C-terminal S-(Gly-Gly)-L-Cys zwitterion residue subset: chebi_ph7_3 is_a: CHEBI:64768 ! zwitterionic group [Term] id: CHEBI:90784 name: aurachin B(1-) subset: chebi_ph7_3 is_a: CHEBI:25696 ! organic anion [Term] id: CHEBI:90785 name: 4-hydroxy-2-methyl-3-oxo-[(2E,6E)-farnesyl]-3,4-dihydroquinoline-1-oxide subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90786 name: 2-methyl-1-oxo-4-[(2E,6E)-farnesyl]-3,4-dihydroquinoline-3,4-diol subset: chebi_ph7_3 is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90790 name: 18(R)-HETE(1-) subset: chebi_ph7_3 is_a: CHEBI:63590 ! 18-HETE(1-) relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90791 name: 3-(1-hydroxyethyl)bacteriochlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90792 name: 3-(1-hydroxyethyl)chlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90793 name: prostaglandin H1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion is_a: CHEBI:62933 ! oxylipin anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90794 name: 3-acetylchlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90795 name: bacteriochlorophyllide a(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90796 name: D-erythrulose 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90797 name: 19-hydroxyprostaglandin H2(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion is_a: CHEBI:62933 ! oxylipin anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90798 name: L-erythrulose 4-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90799 name: dipeptide zwitterion subset: chebi_ph7_3 is_a: CHEBI:60466 ! peptide zwitterion [Term] id: CHEBI:90800 name: beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide [Term] id: CHEBI:90801 name: 19-hydroxyprostaglandin H1(1-) subset: chebi_ph7_3 is_a: CHEBI:59326 ! prostaglandin carboxylic acid anion is_a: CHEBI:62933 ! oxylipin anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90802 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide [Term] id: CHEBI:90803 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide [Term] id: CHEBI:90810 name: 5(S),11(R)-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90811 name: beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide subset: chebi_ph7_3 is_a: CHEBI:23073 ! glycopentaosylceramide is_a: CHEBI:24121 ! fucosyl oligoglycosylceramide [Term] id: CHEBI:90812 name: 5(S),15(R)-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90813 name: 5(S),15(S)-DiHETE(1-) subset: chebi_ph7_3 is_a: CHEBI:131877 ! dihydroxyicosatetraenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:90814 name: 17(R)-HDoHE(1-) subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90815 name: (4Z,7Z,10Z,14E,16Z,19Z)-13-hydroxydocosahexaenoate subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90818 name: 18(R)-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:90819 name: 15(R)-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90820 name: 11(R)-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:131871 ! hydroxy polyunsaturated fatty acid anion is_a: CHEBI:131874 ! HEPE(1-) is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:90821 name: 15-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90822 name: 5-HPETE(1-) subset: chebi_ph7_3 is_a: CHEBI:59720 ! HPETE anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90823 name: 13-HPODE(1-) subset: chebi_ph7_3 is_a: CHEBI:131862 ! HPODE(1-) relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90824 name: (7Z,10Z,13R,14E,16Z,19Z)-13-hydroxydocosapentaenoate subset: chebi_ph7_3 is_a: CHEBI:133654 ! hydroxydocosapentaenoate relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90825 name: 18-HEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90826 name: (5S)-hydroperoxy-18-hydroxy-EPE(1-) subset: chebi_ph7_3 is_a: CHEBI:133653 ! hydroperoxy(hydroxy)icosapentaenoate relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90832 name: NMNH(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:90833 name: 5-hydroperoxy-15-HETE is_a: CHEBI:138327 ! hydroperoxy(hydroxy)icosatetraenoic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90837 name: 3-O-(N-acetyl-beta-D-glucosaminyl)-L-serine is_a: CHEBI:21957 ! O-glycosyl-L-serine is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:90838 name: O-(N-acetyl-beta-D-glucosaminyl)-L-serine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90839 name: 3-O-(N-acetyl-beta-D-glucosaminyl)-L-threonine is_a: CHEBI:21958 ! O-glycosyl-L-threonine is_a: CHEBI:63367 ! monosaccharide derivative is_a: CHEBI:83822 ! non-proteinogenic L-alpha-amino acid [Term] id: CHEBI:90840 name: O-(N-acetyl-beta-D-glucosaminyl)-L-threonine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90849 name: geranylgeranyl bacteriochlorophyllide a(1-) subset: chebi_ph7_3 is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90850 name: 13(S)-HODE(1-) subset: chebi_ph7_3 is_a: CHEBI:133819 ! 13-HODE(1-) [Term] id: CHEBI:90856 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNac-(1->4)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:88057 ! ganglioside GD1(2-) [Term] id: CHEBI:90857 name: bacteriochlorophyllide g(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90858 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1<->1')-N-acylsphingosine(2-) subset: chebi_ph7_3 is_a: CHEBI:90859 ! alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1<->1')-ceramide(2-) [Term] id: CHEBI:90859 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1<->1')-ceramide(2-) subset: chebi_ph7_3 is_a: CHEBI:79346 ! anionic ganglioside [Term] id: CHEBI:90862 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer(4-) subset: chebi_ph7_3 is_a: CHEBI:88059 ! ganglioside GQ1(4-) [Term] id: CHEBI:90866 name: 14-HDoHE(1-) subset: chebi_ph7_3 is_a: CHEBI:131867 ! hydroxydocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90867 name: 14-oxo-DoHE(1-) subset: chebi_ph7_3 is_a: CHEBI:133526 ! oxodocosahexaenoate is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90868 name: validamycin B subset: chebi_ph7_3 is_a: CHEBI:26191 ! polyol is_a: CHEBI:50995 ! secondary amino compound is_a: CHEBI:83745 ! validamycins is_a: CHEBI:87114 ! antibiotic fungicide [Term] id: CHEBI:90869 name: validamycin A(1+) subset: chebi_ph7_3 is_a: CHEBI:35274 ! ammonium ion derivative relationship: has_role CHEBI:33281 ! antimicrobial agent relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:83757 ! EC 2.4.1.231 [alpha,alpha-trehalose phosphorylase (configuration-retaining)] inhibitor relationship: has_role CHEBI:83760 ! EC 2.4.1.64 (alpha,alpha-trehalose phosphorylase) inhibitor relationship: has_role CHEBI:83762 ! EC 3.2.1.28 (alpha,alpha-trehalase) inhibitor relationship: has_role CHEBI:86328 ! antifungal agrochemical [Term] id: CHEBI:90870 name: 3-iodo-L-tyrosine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90871 name: 3,5-diiodo-L-tyrosine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90872 name: L-thyroxine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90873 name: dehydroalanine residue subset: chebi_ph7_3 is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:90874 name: 3,3',5-triiodo-L-thyronine residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90882 name: 3,4-dichlorocatechol subset: chebi_ph7_3 is_a: CHEBI:23699 ! dichlorocatechol relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90883 name: 2,3-dichloromuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:38424 ! dichloromuconate(2-) [Term] id: CHEBI:90884 name: 2'-hydroxyrifampicin(1-) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90885 name: 1,3,7-trimethyl-5-hydroxyisouric acid subset: chebi_ph7_3 is_a: CHEBI:25810 ! oxopurine relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90886 name: 2-hydroxy-6-oxo-2,4-heptadienoic acid is_a: CHEBI:35868 ! hydroxy monocarboxylic acid is_a: CHEBI:35871 ! oxo monocarboxylic acid is_a: CHEBI:51689 ! enone is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90887 name: 2-hydroxy-6-oxo-2,4-heptadienoate subset: chebi_ph7_3 is_a: CHEBI:35976 ! 6-oxo monocarboxylic acid anion is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion relationship: has_role CHEBI:76976 ! bacterial xenobiotic metabolite [Term] id: CHEBI:90888 name: aurachin C subset: chebi_ph7_3 is_a: CHEBI:23765 ! quinolone is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:27171 ! organic heterobicyclic compound is_a: CHEBI:90918 ! C-type aurachin relationship: has_role CHEBI:33282 ! antibacterial agent relationship: has_role CHEBI:76969 ! bacterial metabolite relationship: has_role CHEBI:90921 ! EC 1.8.5.4 (sulfide:quinone reductase) inhibitor [Term] id: CHEBI:90889 name: aurachin C epoxide subset: chebi_ph7_3 is_a: CHEBI:24709 ! hydroxylamines is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:32955 ! epoxide is_a: CHEBI:76224 ! aromatic ketone [Term] id: CHEBI:90890 name: 3-farnesyl-3-hydroxy-2-methyl-1-oxo-1lambda(5)-quinolin-4-one subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:23765 ! quinolone is_a: CHEBI:26508 ! quinoline N-oxide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90891 name: 2-imino-3-(indol-3-yl)propanoic acid is_a: CHEBI:23591 ! dehydroamino acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:27164 ! tryptophan derivative is_a: CHEBI:33272 ! ketimine relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90892 name: 2-imino-3-(indol-3-yl)propanoate is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90893 name: (-)-bursehernin subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25036 ! lignan is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38298 ! benzodioxoles relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:90894 name: (-)-5'-desmethylyatein subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25036 ! lignan is_a: CHEBI:33853 ! phenols is_a: CHEBI:38298 ! benzodioxoles is_a: CHEBI:51681 ! dimethoxybenzene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:90896 name: (-)-pluviatolide subset: chebi_ph7_3 is_a: CHEBI:22950 ! butan-4-olide is_a: CHEBI:25036 ! lignan is_a: CHEBI:33853 ! phenols is_a: CHEBI:35618 ! aromatic ether is_a: CHEBI:38298 ! benzodioxoles relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:90897 name: protoviolaceinic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid is_a: CHEBI:84729 ! hydroxyindoles [Term] id: CHEBI:90898 name: protoviolaceinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:90899 name: violaceinic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90900 name: violaceinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90901 name: protoasukamycin subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:26188 ! polyketide is_a: CHEBI:33823 ! enol is_a: CHEBI:33853 ! phenols is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:51751 ! enamide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90902 name: 4-hydroxyprotoasukamycin subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:26188 ! polyketide is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:33823 ! enol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:51689 ! enone is_a: CHEBI:51751 ! enamide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90903 name: asperlicin E subset: chebi_ph7_3 is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:35412 ! aminal is_a: CHEBI:52157 ! organic heteroheptacyclic compound is_a: CHEBI:91003 ! asperlicins relationship: has_role CHEBI:73296 ! cholecystokinin antagonist relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:90904 name: asperlicin C subset: chebi_ph7_3 is_a: CHEBI:24828 ! indoles is_a: CHEBI:38163 ! organic heterotetracyclic compound is_a: CHEBI:91003 ! asperlicins relationship: has_role CHEBI:73296 ! cholecystokinin antagonist relationship: has_role CHEBI:76956 ! Aspergillus metabolite [Term] id: CHEBI:90906 name: protodeoxyviolaceinic acid is_a: CHEBI:24828 ! indoles is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90907 name: protodeoxyviolaceinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90909 name: deoxyviolaceinic acid is_a: CHEBI:25384 ! monocarboxylic acid is_a: CHEBI:26454 ! pyrrolecarboxylic acid is_a: CHEBI:84729 ! hydroxyindoles relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90910 name: deoxyviolaceinate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90915 name: aurachin is_a: CHEBI:26513 ! quinolines [Term] id: CHEBI:90917 name: A-type aurachin is_a: CHEBI:90915 ! aurachin [Term] id: CHEBI:90918 name: C-type aurachin is_a: CHEBI:90915 ! aurachin [Term] id: CHEBI:90920 name: EC 1.8.5.* (oxidoreductase acting on sulfur group donors, quinone or similar as acceptor) inhibitor is_a: CHEBI:76735 ! EC 1.8.* (oxidoreductase acting on sulfur group of donors) inhibitor [Term] id: CHEBI:90921 name: EC 1.8.5.4 (sulfide:quinone reductase) inhibitor is_a: CHEBI:90920 ! EC 1.8.5.* (oxidoreductase acting on sulfur group donors, quinone or similar as acceptor) inhibitor [Term] id: CHEBI:9093 name: selenocysteine is_a: CHEBI:33704 ! alpha-amino acid relationship: has_part CHEBI:50327 ! selanylmethyl group relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90940 name: N-acetyl-L-phosphinothricin(2-) subset: chebi_ph7_3 is_a: CHEBI:58879 ! N-acetylphosphinothricin(2-) [Term] id: CHEBI:90944 name: dTDP-4-dehydro-2,3,6-trideoxy-alpha-D-glucose(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90945 name: dTDP-4-ammonio-2,3,4,6-tetradeoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:90946 name: dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-alpha-D-glucose(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90947 name: dTDP-alpha-D-forosamine(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90955 name: bacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90956 name: 2-exo-hydroxy-1,4-cineole subset: chebi_ph7_3 is_a: CHEBI:23243 ! cineole relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:9096 name: L-selenohomocysteine is_a: CHEBI:26629 ! selenoamino acid relationship: has_role CHEBI:75768 ! mammalian metabolite [Term] id: CHEBI:90963 name: 3-vinylbacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90964 name: 8,12-diethyl-3-vinylbacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90965 name: bacteriochlorophyllide c(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90966 name: 12-ethyl-8-propyl-3-vinylbacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90967 name: 12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90968 name: 3-vinyl-bacteriochlorophyllide d(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90969 name: 7-hydroxybacteriochlorophyllide c(1-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58941 ! cyclic tetrapyrrole anion [Term] id: CHEBI:90970 name: 1alpha,23(S),25-trihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:33573 ! tetrol is_a: CHEBI:36853 ! hydroxy seco-steroid is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90975 name: O(4)-(N-acetyl-alpha-D-galactosaminyl)-trans-4-hydroxy-L-proline residue subset: chebi_ph7_3 is_a: CHEBI:83228 ! L-alpha-amino acid residue [Term] id: CHEBI:90976 name: 20-hydroxylipoxin A4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:6497 ! lipoxin relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90978 name: 20-hydroxylipoxin B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:6497 ! lipoxin relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90979 name: 5,20-DiHETE is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90980 name: 23(S),25-dihydroxy-24-oxovitamin D3 subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:2468 ! secondary alpha-hydroxy ketone is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:47806 ! oxocalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90982 name: 8,20-DiHETE is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90983 name: (20S)-hydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:23824 ! diol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90984 name: 20(S),25-dihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90985 name: (20S,24R)-dihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90986 name: (20S,24S)-dihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:90987 name: 3-deoxy-D-glycero-beta-D-galacto-nonulosonate 9-phosphate(3-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion is_a: CHEBI:63551 ! carbohydrate acid derivative anion [Term] id: CHEBI:90988 name: 3-deoxy-D-glycero-beta-D-galacto-nonulosonate subset: chebi_ph7_3 is_a: CHEBI:33721 ! carbohydrate acid anion is_a: CHEBI:35757 ! monocarboxylic acid anion relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:90989 name: CMP-3-deoxy-D-glycero-beta-D-galacto-nonulosonate(2-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:90990 name: 12,20-DiHETE is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:90992 name: 20-hydroxy-6-trans-leukotriene B4 is_a: CHEBI:140345 ! hydroxy polyunsaturated fatty acid is_a: CHEBI:140997 ! omega-hydroxy-long-chain fatty acid is_a: CHEBI:25029 ! leukotriene [Term] id: CHEBI:90996 name: 12(S)-HpEPE is_a: CHEBI:78909 ! 12-HPEPE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:9100 name: Sem-tRNA(Met) is_a: CHEBI:2651 ! alpha-aminoacyl-tRNA relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:91000 name: resolvin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91001 name: 18-oxoresolvin E1(1-) subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:59836 ! oxo fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91002 name: sucrose 6(G)-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91003 name: asperlicins is_a: CHEBI:36470 ! quinazoline alkaloid is_a: CHEBI:38166 ! organic heteropolycyclic compound [Term] id: CHEBI:91004 name: D-galactopyranose 6-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:61567 ! D-hexopyranose 6-phosphate(2-) [Term] id: CHEBI:91005 name: 5-[(E)-caffeoyl]shikimate subset: chebi_ph7_3 is_a: CHEBI:36059 ! hydroxy monocarboxylic acid anion is_a: CHEBI:36126 ! cyclohexenecarboxylate relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91007 name: aromatic carboxylate subset: chebi_ph7_3 is_a: CHEBI:29067 ! carboxylic acid anion [Term] id: CHEBI:91010 name: (2Z,4Z)-2,3-dichloromuconic acid is_a: CHEBI:111519 ! 2,3-dichloromuconic acid relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:91011 name: (2Z,4Z)-2,3-dichloromuconate(2-) subset: chebi_ph7_3 is_a: CHEBI:90883 ! 2,3-dichloromuconate(2-) [Term] id: CHEBI:91013 name: D-ribose 5-triphosphate(4-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91020 name: actinorhodin(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:91025 name: erythropoietin inhibitor is_a: CHEBI:35222 ! inhibitor [Term] id: CHEBI:91036 name: phosphatidylinositol 36:3(1-) subset: chebi_ph7_3 is_a: CHEBI:57880 ! 1-phosphatidyl-1D-myo-inositol(1-) [Term] id: CHEBI:9107 name: senecionine is_a: CHEBI:25000 ! lactone is_a: CHEBI:26878 ! tertiary alcohol is_a: CHEBI:64948 ! pyrrolizidine alkaloid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91079 name: purinergic receptor P2 antagonist is_a: CHEBI:48706 ! antagonist [Term] id: CHEBI:91089 name: CMP-8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonate(1-) subset: chebi_ph7_3 is_a: CHEBI:59737 ! nucleotide-sugar oxoanion [Term] id: CHEBI:91118 name: N-acetyl-alpha-D-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:144422 ! N-acetyl-alpha-galactosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide [Term] id: CHEBI:91119 name: alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:90803 ! alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide [Term] id: CHEBI:91121 name: beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphinganine subset: chebi_ph7_3 is_a: CHEBI:23075 ! glycotetraosylceramide [Term] id: CHEBI:91126 name: 2-trans,4-trans-xanthoxin subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:51688 ! enal relationship: has_role CHEBI:35219 ! plant growth retardant relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91128 name: 3-acetylchlorophyllide a is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide is_a: CHEBI:51867 ! methyl ketone relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:91130 name: 2-trans-(+)-abscisic aldehyde subset: chebi_ph7_3 is_a: CHEBI:36758 ! apo carotenoid sesquiterpenoid is_a: CHEBI:48953 ! cyclohexenones is_a: CHEBI:51688 ! enal is_a: CHEBI:51689 ! enone [Term] id: CHEBI:91131 name: geranylgeranyl bacteriochlorophyllide a is_a: CHEBI:28966 ! chlorophyll is_a: CHEBI:33308 ! carboxylic ester [Term] id: CHEBI:91132 name: 18(R)-HETE is_a: CHEBI:63579 ! 18-HETE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91133 name: prostaglandin H1 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91134 name: L-erythrulose 4-phosphate is_a: CHEBI:24980 ! ketotetrose phosphate relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:91135 name: 19-hydroxyprostaglandin H1 is_a: CHEBI:25702 ! organic peroxide is_a: CHEBI:26344 ! prostaglandins H is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:35990 ! bridged compound is_a: CHEBI:61121 ! oxylipin is_a: CHEBI:78840 ! olefinic compound relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91136 name: 5(S),11(R)-DiHETE is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91137 name: 17(R)-HDoHE is_a: CHEBI:72637 ! (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91138 name: 5(S),15(R)-DiHETE is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91139 name: elastin-laminin receptor agonist is_a: CHEBI:48705 ! agonist [Term] id: CHEBI:91140 name: 15(R)-HEPE is_a: CHEBI:72627 ! 15-HEPE relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91143 name: (3S,5R,6S)-beta-cryptoxanthin 5,6-epoxide subset: chebi_ph7_3 is_a: CHEBI:35307 ! epoxycarotenol relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91165 name: capsanthin 5,6-epoxide subset: chebi_ph7_3 is_a: CHEBI:35307 ! epoxycarotenol is_a: CHEBI:35310 ! carotenone relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91175 name: hypusine(2+) residue subset: chebi_ph7_3 is_a: CHEBI:35415 ! alpha-amino-acid residue cation [Term] id: CHEBI:91176 name: deoxyhypusine residue is_a: CHEBI:33710 ! alpha-amino-acid residue [Term] id: CHEBI:91177 name: maltose 6'-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91178 name: N-demethylindolmycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:91179 name: indolmycin(1+) subset: chebi_ph7_3 is_a: CHEBI:25697 ! organic cation [Term] id: CHEBI:91180 name: (R)-3-(indol-3-yl)-2-oxobutyrate subset: chebi_ph7_3 is_a: CHEBI:35179 ! 2-oxo monocarboxylic acid anion [Term] id: CHEBI:91181 name: 2-phosphinomethylmalate(3-) subset: chebi_ph7_3 is_a: CHEBI:35693 ! dicarboxylic acid anion [Term] id: CHEBI:91209 name: glycosmisic acid is_a: CHEBI:134251 ! guaiacols is_a: CHEBI:15734 ! primary alcohol is_a: CHEBI:38830 ! 1-benzofurans is_a: CHEBI:64475 ! guaiacyl lignin is_a: CHEBI:79020 ! alpha,beta-unsaturated monocarboxylic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:91221 name: 2-hydroxyspheroidene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:91223 name: 2,2-dihydroxyspheroidene subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35329 ! carotenoid ether is_a: CHEBI:63734 ! ketone hydrate [Term] id: CHEBI:91227 name: 2-hydroxyspirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:91228 name: 2,2-dihydroxyspirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35329 ! carotenoid ether is_a: CHEBI:63734 ! ketone hydrate [Term] id: CHEBI:91229 name: 2'-hydroxy-2-oxospirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35310 ! carotenone is_a: CHEBI:35329 ! carotenoid ether [Term] id: CHEBI:91230 name: 2',2'-dihydroxy-2-oxospirilloxanthin subset: chebi_ph7_3 is_a: CHEBI:23045 ! carotenol is_a: CHEBI:35310 ! carotenone is_a: CHEBI:35329 ! carotenoid ether is_a: CHEBI:63734 ! ketone hydrate [Term] id: CHEBI:91232 name: 2-amino-3-hydroxy-4-methylbenzoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91233 name: 17-(4-hydroxyphenyl)heptadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:91234 name: 17-(4-hydroxyphenyl)heptadecanoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91235 name: 19-(4-hydroxyphenyl)nonadecanoyl-AMP(1-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91236 name: 19-(4-hydroxyphenyl)nonadecanoate subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion [Term] id: CHEBI:91252 name: valienol 1-phosphate(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91253 name: GDP-valienol(2-) subset: chebi_ph7_3 is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91254 name: phosphonoformate(2-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:59635 ! organophosphonate oxoanion [Term] id: CHEBI:91255 name: CMP-5'-phosphonoformate(3-) subset: chebi_ph7_3 is_a: CHEBI:35757 ! monocarboxylic acid anion is_a: CHEBI:58945 ! organophosphate oxoanion [Term] id: CHEBI:91264 name: 11(R)-HEPE is_a: CHEBI:131889 ! 11-HEPE relationship: has_role CHEBI:67079 ! anti-inflammatory agent relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:84735 ! algal metabolite [Term] id: CHEBI:91268 name: 5-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91271 name: 15-HPETE is_a: CHEBI:24644 ! HPETE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91272 name: 13-HPODE is_a: CHEBI:36329 ! HPODE relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91273 name: pyrrolysine is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:23763 ! pyrroline is_a: CHEBI:51569 ! N-acyl-amino acid is_a: CHEBI:53079 ! lysine derivative [Term] id: CHEBI:91274 name: (7Z,10Z,13R,14E,16Z,19Z)-13-hydroxydocosapentaenoic acid is_a: CHEBI:134651 ! hydroxydocosapentaenoic acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91286 name: 5(S),15(S)-DiHETE is_a: CHEBI:72868 ! dihydroxyicosatetraenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:91287 name: (5S)-hydroperoxy-18-hydroxy-EPE is_a: CHEBI:134645 ! hydroperoxy(hydroxy)icosapentaenoic acid relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91291 name: bacteriochlorophyllide g is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:36244 ! dicarboxylic acid monoester is_a: CHEBI:38206 ! chlorophyllide relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:91292 name: alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1<->1')-N-acylsphingosine is_a: CHEBI:36546 ! sialomonoglycosylceramide [Term] id: CHEBI:91293 name: 14-oxo-DoHE is_a: CHEBI:134542 ! oxodocosahexaenoic acid is_a: CHEBI:51689 ! enone relationship: has_role CHEBI:76967 ! human xenobiotic metabolite [Term] id: CHEBI:91294 name: 12,18-dihydroxyoctadecanoate subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:91295 name: ricinoleate subset: chebi_ph7_3 is_a: CHEBI:57560 ! long-chain fatty acid anion is_a: CHEBI:59835 ! hydroxy fatty acid anion is_a: CHEBI:82680 ! monounsaturated fatty acid anion [Term] id: CHEBI:91296 name: lysophosphatidylethanolamine 18:2 is_a: CHEBI:64574 ! lysophosphatidylethanolamine relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91297 name: lysophosphatidylcholine(0:0/16:0) subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64563 ! lysophosphatidylcholine 16:0 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91299 name: lysophosphatidylcholine(0:0/18:0) subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64561 ! lysophosphatidylcholine 18:0 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91300 name: (9Z,12R)-12,18-dihydroxyoctadecenoate subset: chebi_ph7_3 is_a: CHEBI:131870 ! hydroxy monounsaturated fatty acid anion is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion [Term] id: CHEBI:91301 name: 5,20-diHEPE(1-) subset: chebi_ph7_3 is_a: CHEBI:140992 ! omega-hydroxy-long-chain fatty acid anion is_a: CHEBI:62937 ! icosanoid anion is_a: CHEBI:76567 ! polyunsaturated fatty acid anion [Term] id: CHEBI:91302 name: lysophosphatidylcholine(0:0/18:2) subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64549 ! lysophosphatidylcholine 18:2 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91303 name: lysophosphatidylcholine(0:0/20:4) subset: chebi_ph7_3 is_a: CHEBI:57875 ! 2-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64568 ! lysophosphatidylcholine 20:4 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91306 name: (20S,23)-dihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:27136 ! triol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:91307 name: (20S,23,24)-trihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:33573 ! tetrol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:91308 name: (20S,23,25)-trihydroxyvitamin D3 subset: chebi_ph7_3 is_a: CHEBI:33573 ! tetrol is_a: CHEBI:47042 ! hydroxycalciol is_a: CHEBI:73558 ! D3 vitamins relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:91309 name: lysophosphatidylcholine(18:2/0:0) subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64549 ! lysophosphatidylcholine 18:2 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:91310 name: lysophosphatidylcholine(20:4/0:0) subset: chebi_ph7_3 is_a: CHEBI:58168 ! 1-O-acyl-sn-glycero-3-phosphocholine is_a: CHEBI:64568 ! lysophosphatidylcholine 20:4 relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:915 name: 2,4-dihydroxyhept-2-enedioic acid is_a: CHEBI:24522 ! heptenedioic acid [Term] id: CHEBI:9150 name: simvastatin subset: chebi_ph7_3 is_a: CHEBI:142348 ! hexahydronaphthalenes is_a: CHEBI:18946 ! delta-lactone is_a: CHEBI:35748 ! fatty acid ester is_a: CHEBI:87633 ! statin (semi-synthetic) relationship: has_role CHEBI:173085 ! ferroptosis inducer relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35664 ! EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor relationship: has_role CHEBI:50266 ! prodrug relationship: has_role CHEBI:77255 ! EC 3.4.24.83 (anthrax lethal factor endopeptidase) inhibitor [Term] id: CHEBI:9160 name: single-stranded DNA is_a: CHEBI:16991 ! deoxyribonucleic acid [Term] id: CHEBI:9168 name: sirolimus subset: chebi_ph7_3 is_a: CHEBI:145565 ! macrolide lactam is_a: CHEBI:25698 ! ether is_a: CHEBI:26979 ! organic heterotricyclic compound is_a: CHEBI:35681 ! secondary alcohol is_a: CHEBI:3992 ! cyclic ketone is_a: CHEBI:59770 ! cyclic acetal is_a: CHEBI:87113 ! antibiotic antifungal drug relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:176497 ! geroprotector relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35705 ! immunosuppressive agent relationship: has_role CHEBI:36047 ! antibacterial drug relationship: has_role CHEBI:68481 ! mTOR inhibitor relationship: has_role CHEBI:76969 ! bacterial metabolite [Term] id: CHEBI:9190 name: solasodine is_a: CHEBI:141498 ! hemiaminal ether is_a: CHEBI:26606 ! sapogenin is_a: CHEBI:26767 ! steroid alkaloid is_a: CHEBI:35624 ! azaspiro compound is_a: CHEBI:37948 ! oxaspiro compound is_a: CHEBI:86322 ! alkaloid antibiotic relationship: has_role CHEBI:145047 ! antispermatogenic agent relationship: has_role CHEBI:22586 ! antioxidant relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35488 ! central nervous system depressant relationship: has_role CHEBI:35493 ! antipyretic relationship: has_role CHEBI:35498 ! diuretic relationship: has_role CHEBI:35623 ! anticonvulsant relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:38147 ! cardiotonic drug relationship: has_role CHEBI:50846 ! immunomodulator relationship: has_role CHEBI:50905 ! teratogenic agent relationship: has_role CHEBI:68495 ! apoptosis inducer relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:9192 name: solavetivone subset: chebi_ph7_3 is_a: CHEBI:26658 ! sesquiterpenoid is_a: CHEBI:33599 ! spiro compound is_a: CHEBI:3992 ! cyclic ketone relationship: has_role CHEBI:26115 ! phytoalexin relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:920 name: 2,4-dinitrotoluene subset: chebi_ph7_3 is_a: CHEBI:23822 ! dinitrotoluene [Term] id: CHEBI:9209 name: soyasapogenol B subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:9211 name: soyasaponin I is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:61778 ! triterpenoid saponin is_a: CHEBI:63436 ! carbohydrate acid derivative is_a: CHEBI:63571 ! trisaccharide derivative relationship: has_role CHEBI:62915 ! sialyltransferase inhibitor [Term] id: CHEBI:9300 name: suberic acid is_a: CHEBI:189840 ! dicarboxylic fatty acid is_a: CHEBI:28383 ! alpha,omega-dicarboxylic acid relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:9330 name: sulfamic acid is_a: CHEBI:35719 ! sulfamic acids [Term] id: CHEBI:9337 name: sulfathiazole is_a: CHEBI:35358 ! sulfonamide is_a: CHEBI:38418 ! 1,3-thiazoles is_a: CHEBI:48975 ! substituted aniline is_a: CHEBI:87228 ! sulfonamide antibiotic relationship: has_role CHEBI:35441 ! antiinfective agent relationship: has_role CHEBI:35703 ! xenobiotic relationship: has_role CHEBI:50502 ! EC 2.5.1.15 (dihydropteroate synthase) inhibitor relationship: has_role CHEBI:78298 ! environmental contaminant relationship: has_role CHEBI:88188 ! drug allergen [Term] id: CHEBI:9341 name: sulfinate subset: chebi_ph7_3 is_a: CHEBI:33482 ! sulfur oxoanion [Term] id: CHEBI:9347 name: sulfoglycolithocholic acid is_a: CHEBI:16158 ! steroid sulfate is_a: CHEBI:36255 ! bile acid glycine conjugate [Term] id: CHEBI:9349 name: sulfonyldimethane subset: chebi_ph7_3 is_a: CHEBI:35850 ! sulfone [Term] id: CHEBI:9398 name: tamsulosin is_a: CHEBI:142546 ! 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:37890 ! alpha-adrenergic antagonist [Term] id: CHEBI:9402 name: taraxerol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid is_a: CHEBI:35681 ! secondary alcohol relationship: has_role CHEBI:25212 ! metabolite [Term] id: CHEBI:9407 name: taurochenodeoxycholate subset: chebi_ph7_3 is_a: CHEBI:131879 ! cholanic acid conjugate anion is_a: CHEBI:33554 ! organosulfonate oxoanion relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:9410 name: taurodeoxycholic acid is_a: CHEBI:23219 ! bile acid taurine conjugate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:9440 name: tenuazonic acid is_a: CHEBI:51867 ! methyl ketone is_a: CHEBI:67265 ! beta-diketone is_a: CHEBI:74223 ! pyrrolidin-2-ones relationship: has_role CHEBI:25442 ! mycotoxin relationship: has_role CHEBI:48001 ! protein synthesis inhibitor relationship: has_role CHEBI:84087 ! human urinary metabolite [Term] id: CHEBI:94442 name: [3-carboxy-2-(1-oxohexadecoxy)propyl]-trimethylammonium is_a: CHEBI:35287 ! acylcholine [Term] id: CHEBI:9457 name: terpinolene subset: chebi_ph7_3 is_a: CHEBI:50073 ! p-menthadiene relationship: has_role CHEBI:27311 ! volatile oil component relationship: has_role CHEBI:35717 ! sedative relationship: has_role CHEBI:71692 ! insect repellent relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:9470 name: tetracenomycin C subset: chebi_ph7_3 is_a: CHEBI:139592 ! tertiary alpha-hydroxy ketone is_a: CHEBI:25248 ! methyl ester is_a: CHEBI:48132 ! tetracenomycin [Term] id: CHEBI:9493 name: tetrahymanol subset: chebi_ph7_3 is_a: CHEBI:25872 ! pentacyclic triterpenoid [Term] id: CHEBI:9519 name: thebaine is_a: CHEBI:25418 ! morphinane alkaloid is_a: CHEBI:38164 ! organic heteropentacyclic compound [Term] id: CHEBI:9532 name: thiamine(1+) diphosphate is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 relationship: has_role CHEBI:23357 ! cofactor relationship: has_role CHEBI:78675 ! fundamental metabolite [Term] id: CHEBI:9533 name: thiamine(1+) monophosphate is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:75772 ! Saccharomyces cerevisiae metabolite relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:9534 name: thiamine(1+) triphosphate is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:26948 ! vitamin B1 relationship: has_role CHEBI:140602 ! Arabidopsis thaliana metabolite relationship: has_role CHEBI:75768 ! mammalian metabolite relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:76946 ! fungal metabolite relationship: has_role CHEBI:76971 ! Escherichia coli metabolite relationship: has_role CHEBI:77746 ! human metabolite relationship: has_role CHEBI:86264 ! rat metabolite [Term] id: CHEBI:9553 name: thioglucoside is_a: CHEBI:35275 ! S-glycosyl compound [Term] id: CHEBI:9555 name: tioguanine subset: chebi_ph7_3 is_a: CHEBI:20702 ! 2-aminopurines relationship: has_role CHEBI:149553 ! anticoronaviral agent relationship: has_role CHEBI:35221 ! antimetabolite relationship: has_role CHEBI:35610 ! antineoplastic agent [Term] id: CHEBI:9577 name: (-)-alpha-thujone subset: chebi_ph7_3 is_a: CHEBI:50042 ! alpha-thujone [Term] id: CHEBI:9578 name: (-)-thujopsene subset: chebi_ph7_3 is_a: CHEBI:61736 ! thujopsene relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:9588 name: ticlopidine is_a: CHEBI:37942 ! thienopyridine is_a: CHEBI:83403 ! monochlorobenzenes relationship: has_role CHEBI:48676 ! fibrin modulating drug relationship: has_role CHEBI:50248 ! hematologic agent relationship: has_role CHEBI:50249 ! anticoagulant relationship: has_role CHEBI:50427 ! platelet aggregation inhibitor relationship: has_role CHEBI:68563 ! P2Y12 receptor antagonist [Term] id: CHEBI:9592 name: tiglic acid is_a: CHEBI:36432 ! 2-methylbut-2-enoic acid relationship: has_role CHEBI:76924 ! plant metabolite [Term] id: CHEBI:9638 name: torulene subset: chebi_ph7_3 is_a: CHEBI:23042 ! carotene is_a: CHEBI:48121 ! polyene [Term] id: CHEBI:9661 name: triacetin subset: chebi_ph7_3 is_a: CHEBI:17855 ! triglyceride relationship: has_role CHEBI:46787 ! solvent relationship: has_role CHEBI:60809 ! adjuvant relationship: has_role CHEBI:62803 ! fuel additive relationship: has_role CHEBI:63047 ! food emulsifier relationship: has_role CHEBI:76924 ! plant metabolite relationship: has_role CHEBI:77969 ! food humectant relationship: has_role CHEBI:78059 ! food additive carrier relationship: has_role CHEBI:86327 ! antifungal drug [Term] id: CHEBI:9688 name: trichodermin subset: chebi_ph7_3 is_a: CHEBI:32955 ! epoxide is_a: CHEBI:38163 ! organic heterotetracyclic compound relationship: has_role CHEBI:35610 ! antineoplastic agent relationship: has_role CHEBI:35718 ! antifungal agent relationship: has_role CHEBI:48001 ! protein synthesis inhibitor [Term] id: CHEBI:978 name: 2-(1-hydroxyethyl)thiamine diphosphate is_a: CHEBI:26945 ! thiamine phosphate is_a: CHEBI:63048 ! 1,3-thiazolium cation [Term] id: CHEBI:98 name: (S)-linalool subset: chebi_ph7_3 is_a: CHEBI:17580 ! linalool [Term] id: CHEBI:9889 name: urea-1-carboxylic acid is_a: CHEBI:47857 ! ureas [Term] id: CHEBI:99 name: (-)-maackiain subset: chebi_ph7_3 is_a: CHEBI:73029 ! maackiain [Term] id: CHEBI:9907 name: ursodeoxycholic acid is_a: CHEBI:131620 ! C24-steroid is_a: CHEBI:23775 ! dihydroxy-5beta-cholanic acid is_a: CHEBI:3098 ! bile acid relationship: has_role CHEBI:75771 ! mouse metabolite relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:9937 name: vasopressin is_a: CHEBI:24533 ! heterodetic cyclic peptide is_a: CHEBI:25905 ! peptide hormone [Term] id: CHEBI:994 name: cis,cis-2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate is_a: CHEBI:29044 ! 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate relationship: has_role CHEBI:77746 ! human metabolite [Term] id: CHEBI:995 name: cis,cis-2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid is_a: CHEBI:19448 ! 2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid relationship: has_role CHEBI:75771 ! mouse metabolite [Term] id: CHEBI:9973 name: vibriobactin subset: chebi_ph7_3 is_a: CHEBI:140325 ! secondary carboxamide is_a: CHEBI:46812 ! 1,3-oxazoles relationship: has_role CHEBI:26672 ! siderophore [Term] id: GOCHE:22587 name: substance with antiviral agent role subset: 3_STAR is_a: GOCHE:33281 ! substance with antimicrobial agent role [Term] id: GOCHE:22676 name: substance with auxin role subset: 3_STAR is_a: GOCHE:37848 ! substance with plant hormone role [Term] id: GOCHE:23357 name: substance with cofactor role subset: 3_STAR is_a: GOCHE:52206 ! substance with biochemical role role [Term] id: GOCHE:23530 name: substance with cytokinin role subset: 3_STAR is_a: GOCHE:37848 ! substance with plant hormone role [Term] id: GOCHE:23888 name: substance with drug role subset: 3_STAR is_a: GOCHE:52217 ! substance with pharmaceutical role [Term] id: GOCHE:23924 name: substance with enzyme inhibitor role subset: 3_STAR is_a: GOCHE:35222 ! substance with inhibitor role is_a: GOCHE:52206 ! substance with biochemical role role [Term] id: GOCHE:24020 name: substance with fat-soluble vitamin (role) role subset: 3_STAR is_a: GOCHE:33229 ! substance with vitamin (role) role [Term] id: GOCHE:24028 name: substance with iron(3+) chelator role subset: 1_STAR is_a: GOCHE:38157 ! substance with iron chelator role [Term] id: GOCHE:24127 name: substance with fungicide role subset: 3_STAR is_a: GOCHE:25944 ! substance with pesticide role is_a: GOCHE:35718 ! substance with antifungal agent role [Term] id: GOCHE:24432 name: substance with biological role role subset: 3_STAR is_a: CHEBI:24431 ! chemical entity is_a: GOCHE:50906 ! substance with role role [Term] id: GOCHE:24527 name: substance with herbicide role subset: 3_STAR is_a: GOCHE:25944 ! substance with pesticide role [Term] id: GOCHE:24621 name: substance with hormone role subset: 3_STAR is_a: GOCHE:33280 ! substance with molecular messenger role is_a: GOCHE:48705 ! substance with agonist role [Term] id: GOCHE:24852 name: substance with insecticide role subset: 3_STAR is_a: GOCHE:25944 ! substance with pesticide role [Term] id: GOCHE:24869 name: substance with ionophore role subset: 3_STAR is_a: GOCHE:38632 ! substance with membrane transport modulator role [Term] id: GOCHE:24874 name: substance with iron ionophore role subset: 3_STAR is_a: GOCHE:24869 ! substance with ionophore role [Term] id: GOCHE:25212 name: substance with metabolite role subset: 3_STAR is_a: GOCHE:52206 ! substance with biochemical role role [Term] id: GOCHE:25442 name: substance with mycotoxin role subset: 3_STAR is_a: GOCHE:27026 ! substance with toxin role is_a: GOCHE:76946 ! substance with fungal metabolite role [Term] id: GOCHE:25512 name: substance with neurotransmitter role subset: 3_STAR is_a: GOCHE:33280 ! substance with molecular messenger role [Term] id: GOCHE:25944 name: substance with pesticide role subset: 3_STAR is_a: GOCHE:33232 ! substance with application role [Term] id: GOCHE:26013 name: substance with pheromone role subset: 3_STAR is_a: GOCHE:26645 ! substance with semiochemical role [Term] id: GOCHE:26115 name: substance with phytoalexin role subset: 3_STAR is_a: GOCHE:38231 ! substance with phytotoxin role [Term] id: GOCHE:26155 name: substance with plant growth regulator role subset: 3_STAR is_a: GOCHE:39317 ! substance with growth regulator role [Term] id: GOCHE:26348 name: substance with prosthetic group role subset: 3_STAR is_a: GOCHE:23357 ! substance with cofactor role [Term] id: GOCHE:26645 name: substance with semiochemical role subset: 3_STAR is_a: GOCHE:33280 ! substance with molecular messenger role [Term] id: GOCHE:26672 name: substance with siderophore role subset: 3_STAR is_a: GOCHE:23357 ! substance with cofactor role is_a: GOCHE:24028 ! substance with iron(3+) chelator role is_a: GOCHE:24874 ! substance with iron ionophore role [Term] id: GOCHE:27026 name: substance with toxin role subset: 3_STAR is_a: GOCHE:25212 ! substance with metabolite role is_a: GOCHE:64909 ! substance with poison role [Term] id: GOCHE:27027 name: substance with micronutrient role subset: 3_STAR is_a: GOCHE:33284 ! substance with nutrient role [Term] id: GOCHE:27314 name: substance with water-soluble vitamin (role) role subset: 3_STAR is_a: GOCHE:33229 ! substance with vitamin (role) role [Term] id: GOCHE:33229 name: substance with vitamin (role) role subset: 3_STAR is_a: GOCHE:27027 ! substance with micronutrient role is_a: GOCHE:52206 ! substance with biochemical role role [Term] id: GOCHE:33232 name: substance with application role subset: 3_STAR is_a: CHEBI:24431 ! chemical entity is_a: GOCHE:50906 ! substance with role role [Term] id: GOCHE:33280 name: substance with molecular messenger role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:33281 name: substance with antimicrobial agent role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:33284 name: substance with nutrient role subset: 3_STAR is_a: GOCHE:78295 ! substance with food component role [Term] id: GOCHE:33290 name: substance with food role subset: 3_STAR is_a: GOCHE:52211 ! substance with physiological role role [Term] id: GOCHE:35195 name: substance with surfactant role subset: 3_STAR is_a: GOCHE:63046 ! substance with emulsifier role [Term] id: GOCHE:35221 name: substance with antimetabolite role subset: 3_STAR is_a: GOCHE:52206 ! substance with biochemical role role [Term] id: GOCHE:35222 name: substance with inhibitor role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:35469 name: substance with antidepressant role subset: 3_STAR is_a: GOCHE:35471 ! substance with psychotropic drug role [Term] id: GOCHE:35470 name: substance with central nervous system drug role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:35471 name: substance with psychotropic drug role subset: 3_STAR is_a: GOCHE:35470 ! substance with central nervous system drug role [Term] id: GOCHE:35473 name: substance with tranquilizing drug role subset: 3_STAR is_a: GOCHE:35471 ! substance with psychotropic drug role is_a: GOCHE:35488 ! substance with central nervous system depressant role [Term] id: GOCHE:35476 name: substance with antipsychotic agent role subset: 3_STAR is_a: GOCHE:35473 ! substance with tranquilizing drug role [Term] id: GOCHE:35488 name: substance with central nervous system depressant role subset: 3_STAR is_a: GOCHE:35470 ! substance with central nervous system drug role [Term] id: GOCHE:35498 name: substance with diuretic role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:35523 name: substance with bronchodilator agent role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:35610 name: substance with antineoplastic agent role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:35623 name: substance with anticonvulsant role subset: 3_STAR is_a: GOCHE:35488 ! substance with central nervous system depressant role [Term] id: GOCHE:35703 name: substance with xenobiotic role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:35718 name: substance with antifungal agent role subset: 3_STAR is_a: GOCHE:33281 ! substance with antimicrobial agent role [Term] id: GOCHE:37527 name: substance with acid role subset: 3_STAR is_a: GOCHE:51086 ! substance with chemical role role [Term] id: GOCHE:37845 name: substance with growth hormone role subset: 3_STAR is_a: GOCHE:24621 ! substance with hormone role [Term] id: GOCHE:37848 name: substance with plant hormone role subset: 3_STAR is_a: GOCHE:24621 ! substance with hormone role is_a: GOCHE:26155 ! substance with plant growth regulator role [Term] id: GOCHE:38157 name: substance with iron chelator role subset: 3_STAR is_a: GOCHE:38161 ! substance with chelator role [Term] id: GOCHE:38161 name: substance with chelator role subset: 3_STAR is_a: GOCHE:52214 ! substance with ligand role [Term] id: GOCHE:38231 name: substance with phytotoxin role subset: 3_STAR is_a: GOCHE:27026 ! substance with toxin role is_a: GOCHE:76924 ! substance with plant metabolite role [Term] id: GOCHE:38234 name: substance with DNA polymerase inhibitor role subset: 3_STAR is_a: GOCHE:76815 ! substance with EC 2.7.7.* (nucleotidyltransferase) inhibitor role [Term] id: GOCHE:38632 name: substance with membrane transport modulator role subset: 3_STAR is_a: GOCHE:52208 ! substance with biophysical role role [Term] id: GOCHE:38867 name: substance with anaesthetic role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:39317 name: substance with growth regulator role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:48705 name: substance with agonist role subset: 3_STAR is_a: GOCHE:52210 ! substance with pharmacological role role [Term] id: GOCHE:50112 name: substance with sex hormone role subset: 3_STAR is_a: GOCHE:24621 ! substance with hormone role [Term] id: GOCHE:50113 name: substance with androgen role subset: 3_STAR is_a: GOCHE:50112 ! substance with sex hormone role [Term] id: GOCHE:50114 name: substance with estrogen role subset: 3_STAR is_a: GOCHE:50112 ! substance with sex hormone role [Term] id: GOCHE:50248 name: substance with hematologic agent role subset: 3_STAR is_a: GOCHE:23888 ! substance with drug role [Term] id: GOCHE:50249 name: substance with anticoagulant role subset: 3_STAR is_a: GOCHE:50248 ! substance with hematologic agent role [Term] id: GOCHE:50427 name: substance with platelet aggregation inhibitor role subset: 3_STAR is_a: GOCHE:50248 ! substance with hematologic agent role [Term] id: GOCHE:50790 name: substance with EC 1.14.14.14 (aromatase) inhibitor role subset: 3_STAR is_a: GOCHE:76838 ! substance with EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor role [Term] id: GOCHE:50906 name: substance with role role subset: 3_STAR [Term] id: GOCHE:51086 name: substance with chemical role role subset: 3_STAR is_a: CHEBI:24431 ! chemical entity is_a: GOCHE:50906 ! substance with role role [Term] id: GOCHE:52206 name: substance with biochemical role role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:52208 name: substance with biophysical role role subset: 1_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:52210 name: substance with pharmacological role role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:52211 name: substance with physiological role role subset: 1_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:52214 name: substance with ligand role subset: 3_STAR is_a: GOCHE:51086 ! substance with chemical role role [Term] id: GOCHE:52217 name: substance with pharmaceutical role subset: 3_STAR is_a: GOCHE:33232 ! substance with application role [Term] id: GOCHE:59897 name: substance with EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor role subset: 3_STAR is_a: GOCHE:22587 ! substance with antiviral agent role is_a: GOCHE:38234 ! substance with DNA polymerase inhibitor role [Term] id: GOCHE:60311 name: substance with thyroid hormone role subset: 3_STAR is_a: GOCHE:24621 ! substance with hormone role [Term] id: GOCHE:63046 name: substance with emulsifier role subset: 3_STAR is_a: GOCHE:51086 ! substance with chemical role role [Term] id: GOCHE:64909 name: substance with poison role subset: 3_STAR is_a: GOCHE:24432 ! substance with biological role role [Term] id: GOCHE:71300 name: substance with EC 2.* (transferase) inhibitor role subset: 3_STAR is_a: GOCHE:23924 ! substance with enzyme inhibitor role [Term] id: GOCHE:75763 name: substance with eukaryotic metabolite role subset: 3_STAR is_a: GOCHE:25212 ! substance with metabolite role [Term] id: GOCHE:76668 name: substance with EC 2.7.* (P-containing group transferase) inhibitor role subset: 3_STAR is_a: GOCHE:71300 ! substance with EC 2.* (transferase) inhibitor role [Term] id: GOCHE:76725 name: substance with EC 1.* (oxidoreductase) inhibitor role subset: 3_STAR is_a: GOCHE:23924 ! substance with enzyme inhibitor role [Term] id: GOCHE:76741 name: substance with EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor role subset: 3_STAR is_a: GOCHE:76725 ! substance with EC 1.* (oxidoreductase) inhibitor role [Term] id: GOCHE:76815 name: substance with EC 2.7.7.* (nucleotidyltransferase) inhibitor role subset: 3_STAR is_a: GOCHE:76668 ! substance with EC 2.7.* (P-containing group transferase) inhibitor role [Term] id: GOCHE:76838 name: substance with EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor role subset: 3_STAR is_a: GOCHE:76741 ! substance with EC 1.14.* (oxidoreductase acting on paired donors, with incorporation or reduction of molecular oxygen) inhibitor role [Term] id: GOCHE:76924 name: substance with plant metabolite role subset: 3_STAR is_a: GOCHE:75763 ! substance with eukaryotic metabolite role [Term] id: GOCHE:76946 name: substance with fungal metabolite role subset: 3_STAR is_a: GOCHE:75763 ! substance with eukaryotic metabolite role [Term] id: GOCHE:78295 name: substance with food component role subset: 3_STAR is_a: GOCHE:52211 ! substance with physiological role role [Typedef] id: RO:0000057 xref: RO:0000057 [Typedef] id: RO:0002233 xref: RO:0002233 [Typedef] id: RO:0002234 xref: RO:0002234 [Typedef] id: RO:0002332 xref: RO:0002332 [Typedef] id: RO:0004007 xref: RO:0004007 [Typedef] id: RO:0004008 xref: RO:0004008 [Typedef] id: RO:0004009 xref: RO:0004009 [Typedef] id: has_part name: has part xref: BFO:0000051 is_transitive: true [Typedef] id: has_role name: has role xref: RO:0000087