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CHEBI:87575 - ethyl 4-octenoate

ChEBI IDCHEBI:87575
ChEBI Nameethyl 4-octenoate
Stars
DefinitionA fatty acid ethyl ester of 4-octenoic acid.
Last Modified20 August 2015
Submitternamrata
DownloadsMolfile
FormulaC10H18O2
Net Charge0
Average Mass170.252
Monoisotopic Mass170.13068
SMILES[H]C(=CCCC(=O)OCC)CCC
InChIInChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h6-7H,3-5,8-9H2,1-2H3
InChIKeyWRUZCQAJIHSQPL-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 4-octenoate (CHEBI:87575) has role metabolite (CHEBI:25212)
ethyl 4-octenoate (CHEBI:87575) is a fatty acid ethyl ester (CHEBI:78206)
IUPAC Name 
ethyl oct-4-enoate
Registry NumbersSources
Reaxys:5245279Reaxys