EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H52O5 |
| Net Charge | 0 |
| Average Mass | 456.708 |
| Monoisotopic Mass | 456.38147 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCC |
| InChI | InChI=1S/C27H52O5/c1-3-5-7-9-10-11-12-13-14-15-16-18-20-22-27(30)32-24-25(28)23-31-26(29)21-19-17-8-6-4-2/h25,28H,3-24H2,1-2H3/t25-/m1/s1 |
| InChIKey | NNFWFJOSHUBWOJ-RUZDIDTESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS9100) |
| 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(8:0/0:0/16:0) (CHEBI:230650) is a 1,3-diglyceride (CHEBI:47777) |
| IUPAC Name |
|---|
| [(2R)-2-hydroxy-3-octanoyloxypropyl] hexadecanoate |
| Manual Xrefs | Databases |
|---|---|
| 59692670 | ChemSpider |
| HMDB0092924 | HMDB |