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CHEBI:186681 - DG(13:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]

ChEBI IDCHEBI:186681
ChEBI NameDG(13:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2]
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H64O5
Net Charge0
Average Mass600.925
Monoisotopic Mass600.47538
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCC
InChIInChI=1S/C38H64O5/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-38(41)43-36(34-39)35-42-37(40)32-30-28-26-24-14-12-10-8-6-4-2/h5,7,11,13,16-17,19-20,22-23,36,39H,3-4,6,8-10,12,14-15,18,21,24-35H2,1-2H3/b7-5-,13-11-,17-16-,20-19-,23-22-/t36-/m0/s1
InChIKeyUOMKVZCOOUOPCG-JBMWSKGXSA-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(13:0/22:5(7Z,10Z,13Z,16Z,19Z)/0:0)[iso2] (CHEBI:186681) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name 
[(2S)-1-hydroxy-3-tridecanoyloxypropan-2-yl] (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
Manual XrefsDatabases
LMGL02010376LIPID MAPS
113371356ChemSpider