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CHEBI:170937 - TG(14:1(9Z)/22:0/18:3(6Z,9Z,12Z))
| Formula | C57H102O6 |
| Net Charge | 0 |
| Average Mass | 883.437 |
| Monoisotopic Mass | 882.76764 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C57H102O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-30-25-23-20-17-14-11-8-5-2/h15,17-18,20,25,30,35,38,54H,4-14,16,19,21-24,26-29,31-34,36-37,39-53H2,1-3H3/b18-15-,20-17-,30-25-,38-35-/t54-/m0/s1 |
| InChIKey | VJRAKLSHWUZUGJ-KQNBKZFHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(14:1(9Z)/22:0/18:3(6Z,9Z,12Z)) (CHEBI:170937) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-1-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropan-2-yl] docosanoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0047848 | HMDB |
| 59657013 | ChemSpider |