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CHEBI:131380 - 2-[(9E)-9-octadecenoyl]glycerol

ChEBI IDCHEBI:131380
ChEBI Name2-[(9E)-9-octadecenoyl]glycerol
Stars
ASCII Name2-[(9E)-9-octadecenoyl]glycerol
DefinitionA 2-monoglyceride in which the acyl group is specified as (9E)-9-octadecenoyl.
Last Modified18 May 2017
Submittermwilliams
DownloadsMolfile
FormulaC21H40O4
Net Charge0
Average Mass356.547
Monoisotopic Mass356.29266
SMILESCCCCCCCC/C=C/CCCCCCCC(=O)OC(CO)CO
InChIInChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9+
InChIKeyUPWGQKDVAURUGE-MDZDMXLPSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (26839171)
- MetaboLights (MTBLS298)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2-[(9E)-9-octadecenoyl]glycerol (CHEBI:131380) has functional parent elaidic acid (CHEBI:27997)
2-[(9E)-9-octadecenoyl]glycerol (CHEBI:131380) is a 2-acylglycerol 18:1 (CHEBI:134141)
IUPAC Name 
1,3-dihydroxypropan-2-yl (9E)-octadec-9-enoate
Synonyms  Source
MG(0:0/18:1)ChEBI
MG(0:0/18:1(9E))ChEBI
2-[(9E)-9-octadec-9-enoyl]glycerolChEBI
2-elaidoylglycerolChEBI
Manual XrefsDatabases
4865039ChemSpider
Registry NumbersSources
Reaxys:1728974Reaxys