EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C59H114O5 |
| Net Charge | 0 |
| Average Mass | 903.556 |
| Monoisotopic Mass | 902.86663 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C59H114O5/c1-4-7-10-13-16-19-22-24-26-28-29-30-31-32-33-35-38-41-44-47-50-53-59(61)64-56-57(55-63-58(60)52-49-46-43-40-37-21-18-15-12-9-6-3)62-54-51-48-45-42-39-36-34-27-25-23-20-17-14-11-8-5-2/h24,26,57H,4-23,25,27-56H2,1-3H3/b26-24-/t57-/m0/s1 |
| InChIKey | OHGQZSIZFJHEIP-YONWZPPLSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood serum (BTO:0000133) | MetaboLights (MTBLS2150) |
| 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) |
| TG(14:0/o-18:0/24:1(15Z)) (CHEBI:180789) is a diglyceride (CHEBI:18035) |
| IUPAC Name |
|---|
| [(2S)-2-octadecoxy-3-tetradecanoyloxypropyl] (Z)-tetracos-15-enoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0042945 | HMDB |
| 59652480 | ChemSpider |