EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:172780 - DG(15:0/22:1(13Z)/0:0)

ChEBI IDCHEBI:172780
ChEBI NameDG(15:0/22:1(13Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H76O5
Net Charge0
Average Mass637.043
Monoisotopic Mass636.56928
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCC
InChIInChI=1S/C40H76O5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-40(43)45-38(36-41)37-44-39(42)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h17-18,38,41H,3-16,19-37H2,1-2H3/b18-17-/t38-/m0/s1
InChIKeyFTFFPLQCCJDTQB-WXMDSKLTSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
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(15:0/22:1(13Z)/0:0) (CHEBI:172780) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name 
[(2S)-1-hydroxy-3-pentadecanoyloxypropan-2-yl] (Z)-docos-13-enoate
Manual XrefsDatabases
HMDB0007087HMDB
24765920ChemSpider