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CHEBI:170336 - DG(i-16:0/0:0/i-16:0)

ChEBI IDCHEBI:170336
ChEBI NameDG(i-16:0/0:0/i-16:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H68O5
Net Charge0
Average Mass568.924
Monoisotopic Mass568.50668
SMILESCC(C)CCCCCCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCCCCCCC(C)C
InChIInChI=1S/C35H68O5/c1-31(2)25-21-17-13-9-5-7-11-15-19-23-27-34(37)39-29-33(36)30-40-35(38)28-24-20-16-12-8-6-10-14-18-22-26-32(3)4/h31-33,36H,5-30H2,1-4H3
InChIKeyRGMITWLABSGWEU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
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-16:0/0:0/i-16:0) (CHEBI:170336) is a 1,3-diglyceride (CHEBI:47777)
IUPAC Name 
[2-hydroxy-3-(14-methylpentadecanoyloxy)propyl] 14-methylpentadecanoate
Manual XrefsDatabases
21376239ChemSpider
HMDB0093645HMDB