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CHEBI:170987 - TG(16:0/22:2(13Z,16Z)/16:0)

ChEBI IDCHEBI:170987
ChEBI NameTG(16:0/22:2(13Z,16Z)/16:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC57H106O6
Net Charge0
Average Mass887.469
Monoisotopic Mass886.79894
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C57H106O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-31-23-20-17-14-11-8-5-2)53-62-56(59)50-47-44-41-38-35-32-24-21-18-15-12-9-6-3/h16,19,25-26,54H,4-15,17-18,20-24,27-53H2,1-3H3/b19-16-,26-25-
InChIKeyRRSWDWCGNYDAFV-DHSNEXAOSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
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(16:0/22:2(13Z,16Z)/16:0) (CHEBI:170987) is a triglyceride (CHEBI:17855)
IUPAC Name 
1,3-di(hexadecanoyloxy)propan-2-yl (13Z,16Z)-docosa-13,16-dienoate
Manual XrefsDatabases
30777725ChemSpider
HMDB0044389HMDB