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CHEBI:171864 - 2-Hexenyl octanoate

ChEBI IDCHEBI:171864
ChEBI Name2-Hexenyl octanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H26O2
Net Charge0
Average Mass226.360
Monoisotopic Mass226.19328
SMILESCCC/C=C/COC(=O)CCCCCCC
InChIInChI=1S/C14H26O2/c1-3-5-7-9-10-12-14(15)16-13-11-8-6-4-2/h8,11H,3-7,9-10,12-13H2,1-2H3/b11-8+
InChIKeyIRUGSDVUJNNIMW-DHZHZOJOSA-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 octanoate (CHEBI:171864) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[(E)-hex-2-enyl] octanoate
Manual XrefsDatabases
LMFA07010718LIPID MAPS
HMDB0032321HMDB
4517217ChemSpider
Registry NumbersSources
CAS:85554-72-9ChemIDplus