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CHEBI:171498 - TG(i-19:0/i-16:0/13:0)

ChEBI IDCHEBI:171498
ChEBI NameTG(i-19:0/i-16:0/13:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC51H98O6
Net Charge0
Average Mass807.339
Monoisotopic Mass806.73634
SMILESCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCC(C)C
InChIInChI=1S/C51H98O6/c1-6-7-8-9-10-11-21-26-31-36-41-49(52)55-44-48(57-51(54)43-38-33-28-23-18-17-20-25-30-35-40-47(4)5)45-56-50(53)42-37-32-27-22-16-14-12-13-15-19-24-29-34-39-46(2)3/h46-48H,6-45H2,1-5H3/t48-/m1/s1
InChIKeyKXVBJSHPBZNAKG-QSCHNALKSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) 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(i-19:0/i-16:0/13:0) (CHEBI:171498) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-2-(14-methylpentadecanoyloxy)-3-tridecanoyloxypropyl] 17-methyloctadecanoate
Manual XrefsDatabases
74874156ChemSpider
HMDB0110276HMDB