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CHEBI:87291 - butyl dec-9-enoate

ChEBI IDCHEBI:87291
ChEBI Namebutyl dec-9-enoate
Stars
DefinitionA fatty acid ester obtained by the formal condensation of butan-1-ol with caproleic acid.
Last Modified2 September 2015
Submitternamrata
DownloadsMolfile
FormulaC14H26O2
Net Charge0
Average Mass226.360
Monoisotopic Mass226.19328
SMILESC=CCCCCCCCC(=O)OCCCC
InChIInChI=1S/C14H26O2/c1-3-5-7-8-9-10-11-12-14(15)16-13-6-4-2/h3H,1,4-13H2,2H3
InChIKeyFOGBCOMHVVYKLG-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
butyl dec-9-enoate (CHEBI:87291) has functional parent butan-1-ol (CHEBI:28885)
butyl dec-9-enoate (CHEBI:87291) has functional parent dec-9-enoic acid (CHEBI:32381)
butyl dec-9-enoate (CHEBI:87291) has role metabolite (CHEBI:25212)
butyl dec-9-enoate (CHEBI:87291) is a fatty acid ester (CHEBI:35748)
butyl dec-9-enoate (CHEBI:87291) is a olefinic compound (CHEBI:78840)
IUPAC Name 
butyl dec-9-enoate