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CHEBI:170950 - TG(18:1(9Z)/14:0/22:1(13Z))

ChEBI IDCHEBI:170950
ChEBI NameTG(18:1(9Z)/14:0/22:1(13Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC57H106O6
Net Charge0
Average Mass887.469
Monoisotopic Mass886.79894
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C57H106O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-36-38-41-44-47-50-56(59)62-53-54(63-57(60)51-48-45-42-39-34-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-35-32-30-25-23-20-17-14-11-8-5-2/h24-26,30,54H,4-23,27-29,31-53H2,1-3H3/b26-24-,30-25-/t54-/m0/s1
InChIKeyAEGMJUGKJPFAAT-LRTZKONZSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
TG(18:1(9Z)/14:0/22:1(13Z)) (CHEBI:170950) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-3-[(Z)-octadec-9-enoyl]oxy-2-tetradecanoyloxypropyl] (Z)-docos-13-enoate
Manual XrefsDatabases
59658748ChemSpider
HMDB0049704HMDB