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CHEBI:81560 - resolvin E2
| Formula | C20H30O4 |
| Net Charge | 0 |
| Average Mass | 334.456 |
| Monoisotopic Mass | 334.21441 |
| SMILES | CC[C@@H](O)/C=C/C=C\C/C=C\C/C=C\C=C\[C@@H](O)CCCC(=O)O |
| InChI | InChI=1S/C20H30O4/c1-2-18(21)14-11-9-7-5-3-4-6-8-10-12-15-19(22)16-13-17-20(23)24/h3-4,7-12,14-15,18-19,21-22H,2,5-6,13,16-17H2,1H3,(H,23,24)/b4-3-,9-7-,10-8-,14-11+,15-12+/t18-,19-/m1/s1 |
| InChIKey | KPRHYAOSTOHNQA-NNQKPOSRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo Sapiens (ncbitaxon:9606) | - | PubMed (17114001) | |
| Rattus norvegicus (ncbitaxon:10116) | - | PubMed (26485038) |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Roles: | rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. specialised pro-resolving mediator A class of cell signaling molecules enzymatically derived from n-3 long chain polyunsaturated fatty acids that have important roles in orchestrating the resolution of tissue inflammation. |
| Applications: | anti-inflammatory agent Any compound that has anti-inflammatory effects. specialised pro-resolving mediator A class of cell signaling molecules enzymatically derived from n-3 long chain polyunsaturated fatty acids that have important roles in orchestrating the resolution of tissue inflammation. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| resolvin E2 (CHEBI:81560) has role anti-inflammatory agent (CHEBI:67079) |
| resolvin E2 (CHEBI:81560) has role human xenobiotic metabolite (CHEBI:76967) |
| resolvin E2 (CHEBI:81560) has role rat metabolite (CHEBI:86264) |
| resolvin E2 (CHEBI:81560) is a diol (CHEBI:23824) |
| resolvin E2 (CHEBI:81560) is a hydroxy polyunsaturated fatty acid (CHEBI:140345) |
| resolvin E2 (CHEBI:81560) is a resolvin (CHEBI:132120) |
| resolvin E2 (CHEBI:81560) is a secondary allylic alcohol (CHEBI:134396) |
| resolvin E2 (CHEBI:81560) is conjugate acid of resolvin E2(1−) (CHEBI:133368) |
| Incoming Relation(s) |
| resolvin E2(1−) (CHEBI:133368) is conjugate base of resolvin E2 (CHEBI:81560) |
| IUPAC Name |
|---|
| (5S,6E,8Z,11Z,14Z,16E,18R)-5,18-dihydroxyicosa-6,8,11,14,16-pentaenoic acid |
| Synonyms | Source |
|---|---|
| 5S,18R-Dihydroxy-6E,8Z,11Z,14Z,16E-eicosapentaenoic acid | KEGG COMPOUND |
| RvE2 | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C18173 | KEGG COMPOUND |
| LMFA03070020 | LIPID MAPS |
| CPD66-58 | MetaCyc |
| Registry Numbers | Sources |
|---|---|
| Reaxys:14339384 | Reaxys |
| Citations |
|---|