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CHEBI:172168 - TG(24:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:1(9Z))

ChEBI IDCHEBI:172168
ChEBI NameTG(24:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC63H108O6
Net Charge0
Average Mass961.551
Monoisotopic Mass960.81459
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C63H108O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-33-34-36-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-37-35-32-29-27-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,25,27,32,35,39,42,48,51,60H,4-7,9-10,12-14,16,19,21-24,26,28-31,33-34,36-38,40-41,43-47,49-50,52-59H2,1-3H3/b11-8-,18-15-,20-17-,27-25-,35-32-,42-39-,51-48-/t60-/m1/s1
InChIKeyGGPCBMWGVJUOBT-JWXCVMORSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
TG(24:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/14:1(9Z)) (CHEBI:172168) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] tetracosanoate
Manual XrefsDatabases
59656850ChemSpider
HMDB0047678HMDB