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CHEBI:178949 - TG(8:0/a-21:0/i-15:0)[rac]

ChEBI IDCHEBI:178949
ChEBI NameTG(8:0/a-21:0/i-15:0)[rac]
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SubmitterMetaboLights
DownloadsMolfile
FormulaC47H90O6
Net Charge0
Average Mass751.231
Monoisotopic Mass750.67374
SMILESCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCC(C)CC
InChIInChI=1S/C47H90O6/c1-6-8-9-25-32-37-45(48)51-40-44(41-52-46(49)38-33-28-23-20-16-17-21-26-30-35-42(3)4)53-47(50)39-34-29-24-19-15-13-11-10-12-14-18-22-27-31-36-43(5)7-2/h42-44H,6-41H2,1-5H3/t43?,44-/m0/s1
InChIKeyPTWPPMZHBIZXKM-GGEHFJKESA-N
ChEBI Ontology
Outgoing Relation(s)
TG(8:0/a-21:0/i-15:0)[rac] (CHEBI:178949) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-1-(13-methyltetradecanoyloxy)-3-octanoyloxypropan-2-yl] 18-methylicosanoate
Manual XrefsDatabases
59673859ChemSpider
HMDB0072432HMDB