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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
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CHEBI:87722 - (2
E
)-hexenoate
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ChEBI Name
(2
E
)-hexenoate
ChEBI ID
CHEBI:87722
ChEBI ASCII Name
(2E)-hexenoate
Definition
A monounsaturated fatty acid anion that is the conjugate base of (2
E
)-hexenoic acid.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C6H9O2
Net Charge
-1
Average Mass
113.135
Monoisotopic Mass
113.06080
InChI
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/p-1/b5-4+
InChIKey
NIONDZDPPYHYKY-SNAWJCMRSA-M
SMILES
C(/C=C/CCC)([O-])=O
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
(2
E
)-hexenoate (
CHEBI:87722
)
has role
metabolite (
CHEBI:25212
)
(2
E
)-hexenoate (
CHEBI:87722
)
is a
monounsaturated fatty acid anion (
CHEBI:82680
)
(2
E
)-hexenoate (
CHEBI:87722
)
is conjugate base of
(2
E
)-hexenoic acid (
CHEBI:87721
)
Incoming
(2
E
)-hexenoic acid (
CHEBI:87721
)
is conjugate acid of
(2
E
)-hexenoate (
CHEBI:87722
)
IUPAC Name
(2
E
)-hex-2-enoate
Last Modified
27 August 2015