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CHEBI:171330 - TG(18:1(9Z)/18:1(11Z)/20:3(5Z,8Z,11Z))
| Formula | C59H104O6 |
| Net Charge | 0 |
| Average Mass | 909.475 |
| Monoisotopic Mass | 908.78329 |
| SMILES | CCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C59H104O6/c1-4-7-10-13-16-19-22-25-28-29-32-34-37-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-38-35-31-27-24-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2/h21,24-26,28,30,32,34,40,43,56H,4-20,22-23,27,29,31,33,35-39,41-42,44-55H2,1-3H3/b24-21-,28-25-,30-26-,34-32-,43-40-/t56-/m0/s1 |
| InChIKey | AMEIEKPQGDLWRP-BEPGXJGISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| HeLa cell (BTO:0000567) | 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(18:1(9Z)/18:1(11Z)/20:3(5Z,8Z,11Z)) (CHEBI:171330) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2S)-3-[(Z)-octadec-9-enoyl]oxy-2-[(Z)-octadec-11-enoyl]oxypropyl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate |
| Manual Xrefs | Databases |
|---|---|
| 59659869 | ChemSpider |
| HMDB0049883 | HMDB |