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CHEBI:136573 - (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid
| Formula | C22H34O3 |
| Net Charge | 0 |
| Average Mass | 346.511 |
| Monoisotopic Mass | 346.25079 |
| SMILES | CCC1OC1C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O |
| InChI | InChI=1S/C22H34O3/c1-2-20-21(25-20)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-22(23)24/h3-4,7-10,14,16,20-21H,2,5-6,11-13,15,17-19H2,1H3,(H,23,24)/b4-3-,9-7-,10-8-,16-14- |
| InChIKey | LKOFAUCMWTWGQQ-OUVYEZRBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo Sapiens (ncbitaxon:9606) | - | PubMed (16112640) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid (CHEBI:136573) has functional parent (7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid (CHEBI:53488) |
| (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid (CHEBI:136573) has role human xenobiotic metabolite (CHEBI:76967) |
| (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid (CHEBI:136573) is a epoxydocosatetraenoic acid (CHEBI:136574) |
| (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid (CHEBI:136573) is conjugate acid of (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoate (CHEBI:133935) |
| Incoming Relation(s) |
| (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoate (CHEBI:133935) is conjugate base of (7Z,10Z,13Z,16Z)-19,20-epoxydocosatetraenoic acid (CHEBI:136573) |
| IUPAC Name |
|---|
| (7Z,10Z,13Z,16Z)-18-(3-ethyloxiran-2-yl)octadeca-7,10,13,16-tetraenoic acid |
| Synonyms | Source |
|---|---|
| 19,20-epoxy-(7Z,10Z,13Z,16Z)-docosatetraenoic acid | ChEBI |
| 19(20)-EpDTE | ChEBI |
| 19(20)-EpDoTE | ChEBI |
| Citations |
|---|