EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C47H90O6 |
| Net Charge | 0 |
| Average Mass | 751.231 |
| Monoisotopic Mass | 750.67374 |
| SMILES | CCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC(C)CC |
| InChI | InChI=1S/C47H90O6/c1-5-8-10-12-13-14-15-21-24-27-31-35-39-46(49)52-42-44(41-51-45(48)38-34-29-11-9-6-2)53-47(50)40-36-32-28-25-22-19-17-16-18-20-23-26-30-33-37-43(4)7-3/h43-44H,5-42H2,1-4H3/t43?,44-/m0/s1 |
| InChIKey | OMNGETIAMXTEEJ-GGEHFJKESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(8:0/a-21:0/15:0)[rac] (CHEBI:178824) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-1-octanoyloxy-3-pentadecanoyloxypropan-2-yl] 18-methylicosanoate |
| Manual Xrefs | Databases |
|---|---|
| 59673083 | ChemSpider |
| HMDB0071644 | HMDB |