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CHEBI:170361 - DG(i-15:0/0:0/a-17:0)

ChEBI IDCHEBI:170361
ChEBI NameDG(i-15:0/0:0/a-17:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H68O5
Net Charge0
Average Mass568.924
Monoisotopic Mass568.50668
SMILESCCC(C)CCCCCCCCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCCCCCCC(C)C
InChIInChI=1S/C35H68O5/c1-5-32(4)26-22-18-14-10-6-7-11-15-19-23-27-34(37)39-29-33(36)30-40-35(38)28-24-20-16-12-8-9-13-17-21-25-31(2)3/h31-33,36H,5-30H2,1-4H3/t32?,33-/m0/s1
InChIKeyNFKJFAFDDRFNJH-OBOZPERJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
DG(i-15:0/0:0/a-17:0) (CHEBI:170361) is a 1,3-diglyceride (CHEBI:47777)
IUPAC Name 
[(2S)-2-hydroxy-3-(13-methyltetradecanoyloxy)propyl] 14-methylhexadecanoate
Manual XrefsDatabases
HMDB0093765HMDB
59692836ChemSpider