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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:11594 - 2-coumarate
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ChEBI Name
2-coumarate
ChEBI ID
CHEBI:11594
Definition
A coumarate that is the conjugate base of 2-coumaric acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C9H7O3
Net Charge
-1
Average Mass
163.15008
Monoisotopic Mass
163.04007
InChI
InChI=1S/C9H8O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6,10H,(H,11,12)/p-1
InChIKey
PMOWTIHVNWZYFI-UHFFFAOYSA-M
SMILES
[H]C(=Cc1ccccc1O)C([O-])=O
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2-coumarate (
CHEBI:11594
)
has role
plant metabolite (
CHEBI:76924
)
2-coumarate (
CHEBI:11594
)
is a
coumarate (
CHEBI:23399
)
2-coumarate (
CHEBI:11594
)
is conjugate base of
2-coumaric acid (
CHEBI:18176
)
Incoming
cis
-2-coumarate (
CHEBI:47921
)
is a
2-coumarate (
CHEBI:11594
)
trans
-2-coumarate (
CHEBI:12875
)
is a
2-coumarate (
CHEBI:11594
)
2-coumaric acid (
CHEBI:18176
)
is conjugate acid of
2-coumarate (
CHEBI:11594
)
IUPAC Name
3-(2-hydroxyphenyl)prop-2-enoate
Synonym
Source
3-(2-hydroxyphenyl)acrylate
ChEBI
Registry Numbers
Types
Sources
1146630
Gmelin Registry Number
Gmelin
7022193
Beilstein Registry Number
Beilstein
Last Modified
19 March 2019