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CHEBI:87688 - ethyl 2-heptenoate
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ChEBI Name
ethyl 2-heptenoate
ChEBI ID
CHEBI:87688
Definition
The fatty acid ethyl ester of 2-heptenoic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H16O2
Net Charge
0
Average Mass
156.222
Monoisotopic Mass
156.11503
InChI
InChI=1S/C9H16O2/c1-3-5-6-7-8-9(10)11-4-2/h7-8H,3-6H2,1-2H3
InChIKey
CYLQPOIZDBIXFP-UHFFFAOYSA-N
SMILES
CCCCC(=CC(OCC)=O)[H]
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
ethyl 2-heptenoate (
CHEBI:87688
)
has functional parent
2-heptenoic acid (
CHEBI:36152
)
ethyl 2-heptenoate (
CHEBI:87688
)
has role
metabolite (
CHEBI:25212
)
ethyl 2-heptenoate (
CHEBI:87688
)
is a
fatty acid ethyl ester (
CHEBI:78206
)
IUPAC Name
ethyl hept-2-enoate
Registry Number
Type
Source
1752579
Reaxys Registry Number
Reaxys
Last Modified
27 August 2015