EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C37H72O5 |
| Net Charge | 0 |
| Average Mass | 596.978 |
| Monoisotopic Mass | 596.53798 |
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCCCCCCCC |
| InChI | InChI=1S/C37H72O5/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-32-37(40)42-34-35(38)33-41-36(39)31-29-27-25-23-21-14-12-10-8-6-4-2/h35,38H,3-34H2,1-2H3/t35-/m1/s1 |
| InChIKey | CHCMVIYQYAURFF-PGUFJCEWSA-N |
| Roles Classification |
|---|
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| DG(14:0/0:0/20:0) (CHEBI:196644) is a 1,3-diglyceride (CHEBI:47777) |
| IUPAC Name |
|---|
| [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] icosanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0094145 | HMDB |
| 59693204 | ChemSpider |