EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C65H118O6 |
| Net Charge | 0 |
| Average Mass | 995.653 |
| Monoisotopic Mass | 994.89284 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCCCC |
| InChI | InChI=1S/C65H118O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-38-35-33-31-29-26-23-20-17-14-11-8-5-2/h18,21,27,30-33,36,62H,4-17,19-20,22-26,28-29,34-35,37-61H2,1-3H3/b21-18-,32-30-,33-31-,36-27-/t62-/m1/s1 |
| InChIKey | FNZGDNSCLKAVDY-YZJLBMTBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | |||
| serum (BTO:0000133) | MetaboLights (MTBLS1887) | ||
| liver (BTO:0000759) | MetaboLights (MTBLS1887) | ||
| heart (BTO:0000562) | MetaboLights (MTBLS1887) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(62:4) (CHEBI:189627) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-2-[(Z)-docos-11-enoyl]oxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] (Z)-docos-11-enoate |
| Manual Xrefs | Databases |
|---|---|
| 113371723 | ChemSpider |
| LMGL03013044 | LIPID MAPS |