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CHEBI:170284 - DG(i-20:0/12:0/0:0)

ChEBI IDCHEBI:170284
ChEBI NameDG(i-20:0/12:0/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H68O5
Net Charge0
Average Mass568.924
Monoisotopic Mass568.50668
SMILESCCCCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCC(C)C
InChIInChI=1S/C35H68O5/c1-4-5-6-7-8-15-20-23-26-29-35(38)40-33(30-36)31-39-34(37)28-25-22-19-17-14-12-10-9-11-13-16-18-21-24-27-32(2)3/h32-33,36H,4-31H2,1-3H3/t33-/m0/s1
InChIKeyXLUNRJLHSJABNU-XIFFEERXSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
DG(i-20:0/12:0/0:0) (CHEBI:170284) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name 
[(2S)-2-dodecanoyloxy-3-hydroxypropyl] 18-methylnonadecanoate
Manual XrefsDatabases
HMDB0094127HMDB
74858543ChemSpider