EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C47H90O6 |
| Net Charge | 0 |
| Average Mass | 751.231 |
| Monoisotopic Mass | 750.67374 |
| SMILES | CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCC(C)CC)COC(=O)CCCCCCCCCCCC(C)C |
| InChI | InChI=1S/C47H90O6/c1-6-8-9-25-34-39-47(50)53-44(41-52-46(49)38-33-29-24-20-16-17-21-26-30-35-42(3)4)40-51-45(48)37-32-28-23-19-15-13-11-10-12-14-18-22-27-31-36-43(5)7-2/h42-44H,6-41H2,1-5H3/t43?,44-/m0/s1 |
| InChIKey | RDACEULRHMKYDD-GGEHFJKESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(a-21:0/8:0/i-15:0)[rac] (CHEBI:178873) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-3-(13-methyltetradecanoyloxy)-2-octanoyloxypropyl] 18-methylicosanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0065791 | HMDB |
| 59666347 | ChemSpider |