EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C50H98O5 |
| Net Charge | 0 |
| Average Mass | 779.329 |
| Monoisotopic Mass | 778.74143 |
| SMILES | CCCCCCCCCCCCCCCCCCOC[C@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCC |
| InChI | InChI=1S/C50H98O5/c1-4-7-10-13-16-19-22-24-25-26-27-30-33-36-39-42-45-53-46-48(47-54-49(51)43-40-37-34-31-28-21-18-15-12-9-6-3)55-50(52)44-41-38-35-32-29-23-20-17-14-11-8-5-2/h48H,4-47H2,1-3H3/t48-/m1/s1 |
| InChIKey | LKKOPCFTBFSGGJ-QSCHNALKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood plasma (BTO:0000131) | MetaboLights (MTBLS2633) |
| 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) |
| TG(14:0/15:0/o-18:0) (CHEBI:172826) is a diglyceride (CHEBI:18035) |
| IUPAC Name |
|---|
| [(2R)-1-octadecoxy-3-tetradecanoyloxypropan-2-yl] pentadecanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0042120 | HMDB |
| 59651685 | ChemSpider |