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CHEBI:170814 - TG(20:3(5Z,8Z,11Z)/16:0/18:2(9Z,12Z))
| Formula | C57H100O6 |
| Net Charge | 0 |
| Average Mass | 881.421 |
| Monoisotopic Mass | 880.75199 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
| InChI | InChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-25-27-28-30-33-35-38-41-44-47-50-56(59)62-53-54(63-57(60)51-48-45-42-39-36-31-24-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h17,20,25-27,29-30,33,38,41,54H,4-16,18-19,21-24,28,31-32,34-37,39-40,42-53H2,1-3H3/b20-17-,27-25-,29-26-,33-30-,41-38-/t54-/m1/s1 |
| InChIKey | AMYBBMIDIXFAAQ-ASRHAWKCSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| 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(20:3(5Z,8Z,11Z)/16:0/18:2(9Z,12Z)) (CHEBI:170814) is a triglyceride (CHEBI:17855) |
| IUPAC Name |
|---|
| [(2R)-2-hexadecanoyloxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] (5Z,8Z,11Z)-icosa-5,8,11-trienoate |
| Manual Xrefs | Databases |
|---|---|
| 59658861 | ChemSpider |
| HMDB0050908 | HMDB |