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CHEBI:88987 - TG(18:1(11Z)/16:1(9Z)/18:2(9Z,12Z))[iso6]

ChEBI IDCHEBI:88987
ChEBI NameTG(18:1(11Z)/16:1(9Z)/18:2(9Z,12Z))[iso6]
Stars
Last Modified20 February 2018
DownloadsMolfile
FormulaC55H98O6
Net Charge0
Average Mass855.383
Monoisotopic Mass854.73634
SMILES[H][C@](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(COC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCC/C=C\CCCCCC
InChIInChI=1S/C55H98O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h16,19-21,23-25,27,52H,4-15,17-18,22,26,28-51H2,1-3H3/b19-16-,23-20-,24-21-,27-25-/t52-/m0/s1
InChIKeyMNILNAZWJQGFRP-FJBDFYQDSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood (UBERON:0000178) PubMed (20671299)
blood serum (BTO:0000133) MetaboLights (MTBLS92) From MetaboLights
ChEBI Ontology
Outgoing Relation(s)
TG(18:1(11Z)/16:1(9Z)/18:2(9Z,12Z))[iso6] (CHEBI:88987) is a triglyceride (CHEBI:17855)
IUPAC Name 
(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-[(11Z)-octadec-11-enoyloxy]propyl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
TG(52:4)HMDB
TAG(18:1/16:1/18:2)HMDB
TG(18:1n7/16:1n7/18:2n6)HMDB
1-Vaccenoyl-2-palmitoleoyl-3-linoleoyl-glycerolHMDB
TAG(18:1n7/16:1n7/18:2n6)HMDB
TG(18:1w7/16:1w7/18:2w6)HMDB
Manual XrefsDatabases
HMDB0010444HMDB
Citations