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CHEBI:171728 - TG(14:0/20:2n6/20:4(5Z,8Z,11Z,14Z))

ChEBI IDCHEBI:171728
ChEBI NameTG(14:0/20:2n6/20:4(5Z,8Z,11Z,14Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC57H98O6
Net Charge0
Average Mass879.405
Monoisotopic Mass878.73634
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C57H98O6/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/h16-17,19-20,24-27,30,32,38,41,54H,4-15,18,21-23,28-29,31,33-37,39-40,42-53H2,1-3H3/b19-16-,20-17-,26-24-,27-25-,32-30-,41-38-/t54-/m0/s1
InChIKeyYFFIQOSQQILEOJ-AYUJWHRRSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
TG(14:0/20:2n6/20:4(5Z,8Z,11Z,14Z)) (CHEBI:171728) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-tetradecanoyloxypropan-2-yl] (11Z,14Z)-icosa-11,14-dienoate
Manual XrefsDatabases
59652137ChemSpider
HMDB0042590HMDB