CHEBI:87291 - butyl dec-9-enoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name butyl dec-9-enoate
ChEBI ID CHEBI:87291
Definition A fatty acid ester obtained by the formal condensation of butan-1-ol with caproleic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C14H26O2
Net Charge 0
Average Mass 226.35500
Monoisotopic Mass 226.19328
InChI InChI=1S/C14H26O2/c1-3-5-7-8-9-10-11-12-14(15)16-13-6-4-2/h3H,1,4-13H2,2H3
InChIKey FOGBCOMHVVYKLG-UHFFFAOYSA-N
SMILES CCCCOC(=O)CCCCCCCC=C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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
Last Modified
02 September 2015