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CHEBI:171513 - TG(i-19:0/a-17:0/12:0)[rac]

ChEBI IDCHEBI:171513
ChEBI NameTG(i-19:0/a-17:0/12:0)[rac]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC51H98O6
Net Charge0
Average Mass807.339
Monoisotopic Mass806.73634
SMILESCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCC(C)CC
InChIInChI=1S/C51H98O6/c1-6-8-9-10-11-19-26-31-36-41-49(52)55-44-48(57-51(54)43-38-33-28-23-18-17-21-25-30-35-40-47(5)7-2)45-56-50(53)42-37-32-27-22-16-14-12-13-15-20-24-29-34-39-46(3)4/h46-48H,6-45H2,1-5H3/t47?,48-/m1/s1
InChIKeyABEWWSPERKWOKG-YZMWRMHMSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) 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/a-17:0/12:0)[rac] (CHEBI:171513) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2R)-3-dodecanoyloxy-2-(14-methylhexadecanoyloxy)propyl] 17-methyloctadecanoate
Manual XrefsDatabases
74874267ChemSpider
HMDB0110389HMDB