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CHEBI:171834 - 2-Hexenyl hexanoate

ChEBI IDCHEBI:171834
ChEBI Name2-Hexenyl hexanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O2
Net Charge0
Average Mass198.306
Monoisotopic Mass198.16198
SMILESCCC/C=C/COC(=O)CCCCC
InChIInChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h7,9H,3-6,8,10-11H2,1-2H3/b9-7+
InChIKeyUQPLEMTXCSYMEK-VQHVLOKHSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
2-Hexenyl hexanoate (CHEBI:171834) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[(E)-hex-2-enyl] hexanoate
Manual XrefsDatabases
4509759ChemSpider
HMDB0038924HMDB
LMFA07010587LIPID MAPS
Registry NumbersSources
CAS:53398-86-0ChemIDplus