EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C47H90O6 |
| Net Charge | 0 |
| Average Mass | 751.231 |
| Monoisotopic Mass | 750.67374 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC(C)C)OC(=O)CCCCCCC |
| InChI | InChI=1S/C47H90O6/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-27-31-34-38-45(48)51-41-44(53-47(50)40-36-29-10-8-6-2)42-52-46(49)39-35-32-28-25-24-26-30-33-37-43(3)4/h43-44H,5-42H2,1-4H3/t44-/m0/s1 |
| InChIKey | FZYSQRFIAGAKOD-SJARJILFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(22:0/8:0/i-14:0) (CHEBI:178783) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-3-(12-methyltridecanoyloxy)-2-octanoyloxypropyl] docosanoate |
| Manual Xrefs | Databases |
|---|---|
| 59669277 | ChemSpider |
| HMDB0067768 | HMDB |