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CHEBI:231228 - TG(14:0/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))

ChEBI IDCHEBI:231228
ChEBI NameTG(14:0/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC53H90O6
Net Charge0
Average Mass823.297
Monoisotopic Mass822.67374
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCC
InChIInChI=1S/C53H90O6/c1-4-7-10-13-16-19-22-23-24-25-26-27-28-29-32-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-31-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-20-17-14-11-8-5-2/h7,10,15-16,18-19,23-24,26-27,29,32,50H,4-6,8-9,11-14,17,20-22,25,28,30-31,33-49H2,1-3H3/b10-7-,18-15-,19-16-,24-23-,27-26-,32-29-/t50-/m1/s1
InChIKeyGNHKCTSTDSUJJA-QMHFOXRFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
TG(14:0/14:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z)) (CHEBI:231228) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-3-tetradecanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
Manual XrefsDatabases
LMGL03014164LIPID MAPS
113372539ChemSpider