EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C52H98O6 |
| Net Charge | 0 |
| Average Mass | 819.350 |
| Monoisotopic Mass | 818.73634 |
| SMILES | CCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCC |
| InChI | InChI=1S/C52H98O6/c1-4-7-10-13-16-19-22-25-26-28-31-33-36-39-42-45-51(54)57-48-49(58-52(55)46-43-40-37-34-29-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-30-27-23-20-17-14-11-8-5-2/h20,23,49H,4-19,21-22,24-48H2,1-3H3/b23-20-/t49-/m1/s1 |
| InChIKey | ZPPRXSIIYZXCGY-KMTXBVSESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Arisaema erubescens (ncbitaxon:228806) | bulb (BTO:0000159) | MetaboLights (MTBLS2858) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(18:0/15:0/16:1(9Z)) (CHEBI:178186) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-3-[(Z)-hexadec-9-enoyl]oxy-2-pentadecanoyloxypropyl] octadecanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0044700 | HMDB |
| 59654112 | ChemSpider |