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CHEBI:176700 - TG(18:2(9Z,12Z)/20:0/20:1(11Z))[iso6]

ChEBI IDCHEBI:176700
ChEBI NameTG(18:2(9Z,12Z)/20:0/20:1(11Z))[iso6]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC61H112O6
Net Charge0
Average Mass941.561
Monoisotopic Mass940.84589
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C61H112O6/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)67-61(64)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h18,21,25,27-28,32,58H,4-17,19-20,22-24,26,29-31,33-57H2,1-3H3/b21-18-,28-25-,32-27-/t58-/m1/s1
InChIKeyWYUNJFXMLHILJN-MSTBSTCSSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
ChEBI Ontology
Outgoing Relation(s)
TG(18:2(9Z,12Z)/20:0/20:1(11Z))[iso6] (CHEBI:176700) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-1-[(Z)-icos-11-enoyl]oxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropan-2-yl] icosanoate
Manual XrefsDatabases
HMDB0050380HMDB
7823699ChemSpider
LMGL03010788LIPID MAPS