EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C36H62O5 |
| Net Charge | 0 |
| Average Mass | 574.887 |
| Monoisotopic Mass | 574.45973 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCC |
| InChI | InChI=1S/C36H62O5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-31-36(39)41-34(32-37)33-40-35(38)30-28-26-24-22-14-12-10-8-6-4-2/h11,13,16-17,19-20,23,25,34,37H,3-10,12,14-15,18,21-22,24,26-33H2,1-2H3/b13-11-,17-16-,20-19-,25-23-/t34-/m0/s1 |
| InChIKey | FWGIBVDRTLDAHU-SQPUOAHRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2224) |
| Roles Classification |
|---|
| Biological Roles: | Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| DG(13:0/20:4(5Z,8Z,11Z,14Z)/0:0)[iso2] (CHEBI:188202) is a 1,2-diglyceride (CHEBI:49172) |
| IUPAC Name |
|---|
| [(2S)-1-hydroxy-3-tridecanoyloxypropan-2-yl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate |
| Manual Xrefs | Databases |
|---|---|
| 113371350 | ChemSpider |
| LMGL02010368 | LIPID MAPS |