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CHEBI:171478 - TG(20:0/20:2n6/14:1(9Z))

ChEBI IDCHEBI:171478
ChEBI NameTG(20:0/20:2n6/14:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC57H104O6
Net Charge0
Average Mass885.453
Monoisotopic Mass884.78329
SMILESCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C57H104O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,25,27,54H,4-14,16,19,21-24,26,28-53H2,1-3H3/b18-15-,20-17-,27-25-/t54-/m1/s1
InChIKeySNGHDWHBYJYQOD-MERPXKMWSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
TG(20:0/20:2n6/14:1(9Z)) (CHEBI:171478) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] icosanoate
Manual XrefsDatabases
59655242ChemSpider
HMDB0045922HMDB