EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C47H90O6 |
| Net Charge | 0 |
| Average Mass | 751.231 |
| Monoisotopic Mass | 750.67374 |
| SMILES | CCCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCC)COC(=O)CCCCCCCCCCC(C)CC |
| InChI | InChI=1S/C47H90O6/c1-5-8-10-12-13-14-15-16-17-18-19-20-21-22-23-28-32-36-40-47(50)53-44(41-51-45(48)38-34-29-11-9-6-2)42-52-46(49)39-35-31-27-25-24-26-30-33-37-43(4)7-3/h43-44H,5-42H2,1-4H3/t43?,44-/m0/s1 |
| InChIKey | PYVDHUVADJGMOP-GGEHFJKESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(8:0/21:0/a-15:0)[rac] (CHEBI:178917) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-1-(12-methyltetradecanoyloxy)-3-octanoyloxypropan-2-yl] henicosanoate |
| Manual Xrefs | Databases |
|---|---|
| 59674215 | ChemSpider |
| HMDB0072736 | HMDB |