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CHEBI:179106 - TG(8:0/8:0/i-12:0)

ChEBI IDCHEBI:179106
ChEBI NameTG(8:0/8:0/i-12:0)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H58O6
Net Charge0
Average Mass526.799
Monoisotopic Mass526.42334
SMILESCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCC(C)C)OC(=O)CCCCCCC
InChIInChI=1S/C31H58O6/c1-5-7-9-13-18-22-29(32)35-25-28(37-31(34)24-20-14-10-8-6-2)26-36-30(33)23-19-16-12-11-15-17-21-27(3)4/h27-28H,5-26H2,1-4H3/t28-/m0/s1
InChIKeyXBIYZIDGFSGBTD-NDEPHWFRSA-N
ChEBI Ontology
Outgoing Relation(s)
TG(8:0/8:0/i-12:0) (CHEBI:179106) is a triglyceride (CHEBI:17855)
IUPAC Name 
[(2S)-2,3-di(octanoyloxy)propyl] 10-methylundecanoate
Manual XrefsDatabases
HMDB0071469HMDB
59672909ChemSpider