EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C51H98O6 |
| Net Charge | 0 |
| Average Mass | 807.339 |
| Monoisotopic Mass | 806.73634 |
| SMILES | CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCC(C)C |
| InChI | InChI=1S/C51H98O6/c1-5-7-9-11-13-15-16-17-20-24-28-32-36-40-44-51(54)57-48(45-55-49(52)42-38-34-30-25-14-12-10-8-6-2)46-56-50(53)43-39-35-31-27-23-21-18-19-22-26-29-33-37-41-47(3)4/h47-48H,5-46H2,1-4H3/t48-/m1/s1 |
| InChIKey | IIKUVZCJXSFDEG-QSCHNALKSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(i-19:0/17:0/12:0) (CHEBI:171506) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2R)-3-dodecanoyloxy-2-heptadecanoyloxypropyl] 17-methyloctadecanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0110396 | HMDB |
| 74874274 | ChemSpider |