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CHEBI:170944 - TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z))
| Formula | C57H102O6 |
| Net Charge | 0 |
| Average Mass | 883.437 |
| Monoisotopic Mass | 882.76764 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
| InChI | InChI=1S/C57H102O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-30-25-23-20-17-14-11-8-5-2/h15-16,18-20,23-24,26,54H,4-14,17,21-22,25,27-53H2,1-3H3/b18-15-,19-16-,23-20-,26-24-/t54-/m0/s1 |
| InChIKey | XUSMNDFFJSIIQR-PVVBFDGQSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| Homo sapiens (ncbitaxon:9606) | |||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(14:1(9Z)/18:1(11Z)/22:2(13Z,16Z)) (CHEBI:170944) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2R)-2-[(Z)-octadec-11-enoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] (13Z,16Z)-docosa-13,16-dienoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0047944 | HMDB |
| 59657105 | ChemSpider |