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CHEBI:187299 - DG(17:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2]

ChEBI IDCHEBI:187299
ChEBI NameDG(17:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H68O5
Net Charge0
Average Mass628.979
Monoisotopic Mass628.50668
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCC
InChIInChI=1S/C40H68O5/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(43)45-38(36-41)37-44-39(42)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21,23,27,29,38,41H,3-4,6,8-10,12,14-16,18,20,22,24-26,28,30-37H2,1-2H3/b7-5-,13-11-,19-17-,23-21-,29-27-/t38-/m0/s1
InChIKeyQQCPIPQJEHTNMH-WWEFPAQVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
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(17:0/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2] (CHEBI:187299) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name 
[(2S)-1-heptadecanoyloxy-3-hydroxypropan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Manual XrefsDatabases
7822710ChemSpider
LMGL02010094LIPID MAPS