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CHEBI:170367 - TG(22:2(13Z,16Z)/16:0/18:4(6Z,9Z,12Z,15Z))
| Formula | C59H102O6 |
| Net Charge | 0 |
| Average Mass | 907.459 |
| Monoisotopic Mass | 906.76764 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCC |
| InChI | InChI=1S/C59H102O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-32-35-37-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-38-33-24-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-34-31-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-20,25-27,31,36,39,56H,4-7,9-10,12-15,18,21-24,28-30,32-35,37-38,40-55H2,1-3H3/b11-8-,19-16-,20-17-,27-25-,31-26-,39-36-/t56-/m1/s1 |
| InChIKey | HCWPBYAJSUXUHV-UFFMMEJQSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| TG(22:2(13Z,16Z)/16:0/18:4(6Z,9Z,12Z,15Z)) (CHEBI:170367) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-2-hexadecanoyloxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] (13Z,16Z)-docosa-13,16-dienoate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0054365 | HMDB |
| 59663038 | ChemSpider |