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CHEBI:87312 - ethyl 3-nonenoate

ChEBI IDCHEBI:87312
ChEBI Nameethyl 3-nonenoate
Stars
DefinitionA fatty acid ethyl ester obtained by the formal condensation of 3-nonenoic acid with ethanol.
Last Modified2 September 2015
Submitternamrata
DownloadsMolfile
FormulaC11H20O2
Net Charge0
Average Mass184.279
Monoisotopic Mass184.14633
SMILES[H]C(=CCC(=O)OCC)CCCCC
InChIInChI=1S/C11H20O2/c1-3-5-6-7-8-9-10-11(12)13-4-2/h8-9H,3-7,10H2,1-2H3
InChIKeyKQCNXVHFHZAHDW-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)
ethyl 3-nonenoate (CHEBI:87312) has role metabolite (CHEBI:25212)
ethyl 3-nonenoate (CHEBI:87312) is a fatty acid ethyl ester (CHEBI:78206)
IUPAC Name 
ethyl non-3-enoate
Registry NumbersSources
Reaxys:6174744Reaxys