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CHEBI:170600 - TG(18:1(11Z)/14:1(9Z)/18:1(9Z))

ChEBI IDCHEBI:170600
ChEBI NameTG(18:1(11Z)/14:1(9Z)/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC53H96O6
Net Charge0
Average Mass829.345
Monoisotopic Mass828.72069
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCC/C=C\CCCCCC
InChIInChI=1S/C53H96O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-51(54)57-48-50(59-53(56)47-44-41-38-35-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h15,18-19,22,25,27,50H,4-14,16-17,20-21,23-24,26,28-49H2,1-3H3/b18-15-,22-19-,27-25-/t50-/m0/s1
InChIKeyGNBFJJGRWFFTKH-UHWDXPKASA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
ChEBI Ontology
Outgoing Relation(s)
TG(18:1(11Z)/14:1(9Z)/18:1(9Z)) (CHEBI:170600) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-3-[(Z)-octadec-11-enoyl]oxy-2-[(Z)-tetradec-9-enoyl]oxypropyl] (Z)-octadec-9-enoate
Manual XrefsDatabases
HMDB0049220HMDB
59658289ChemSpider