EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:90812 - 5(S),15(R)-DiHETE(1−)
| Formula | C20H31O4 |
| Net Charge | -1 |
| Average Mass | 335.464 |
| Monoisotopic Mass | 335.22278 |
| SMILES | CCCCC[C@@H](O)/C=C/C=C\C/C=C\C=C\[C@@H](O)CCCC(=O)[O-] |
| InChI | InChI=1S/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/p-1/b7-5-,8-6-,14-10+,15-11+/t18-,19-/m1/s1 |
| InChIKey | UXGXCGPWGSUMNI-YLMOWEDUSA-M |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | PubMed (22068350) |
| Roles Classification |
|---|
| Biological Role: | human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) has role human xenobiotic metabolite (CHEBI:76967) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is a dihydroxyicosatetraenoate (CHEBI:131877) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is a hydroxy fatty acid anion (CHEBI:59835) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is a icosanoid anion (CHEBI:62937) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is a long-chain fatty acid anion (CHEBI:57560) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is a polyunsaturated fatty acid anion (CHEBI:76567) |
| 5(S),15(R)-DiHETE(1−) (CHEBI:90812) is conjugate base of 5(S),15(R)-DiHETE (CHEBI:91138) |
| Incoming Relation(s) |
| 5(S),15(R)-DiHETE (CHEBI:91138) is conjugate acid of 5(S),15(R)-DiHETE(1−) (CHEBI:90812) |
| IUPAC Name |
|---|
| (5S,6E,8Z,11Z,13E,15R)-5,15-dihydroxyicosa-6,8,11,13-tetraenoate |
| Synonym | Source |
|---|---|
| (5S,6E,8Z,11Z,13E,15R)-5,15-dihydroxyicosatetraenoate | ChEBI |
| UniProt Name | Source |
|---|---|
| (5S,15R)-dihydroxy-(6E,8Z,11Z,13E)-eicosatetraenoate | UniProt |
| Citations |
|---|