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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:12875 -
trans
-2-coumarate
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ChEBI Name
trans
-2-coumarate
ChEBI ID
CHEBI:12875
ChEBI ASCII Name
trans-2-coumarate
Definition
The
trans
-isomer of 2-coumarate.
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/b6-5+
InChIKey
PMOWTIHVNWZYFI-AATRIKPKSA-M
SMILES
Oc1ccccc1\C=C\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.
(via
2-coumarate
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
trans
-2-coumarate (
CHEBI:12875
)
is a
2-coumarate (
CHEBI:11594
)
trans
-2-coumarate (
CHEBI:12875
)
is conjugate base of
trans
-2-coumaric acid (
CHEBI:18125
)
Incoming
trans
-2-coumaric acid (
CHEBI:18125
)
is conjugate acid of
trans
-2-coumarate (
CHEBI:12875
)
IUPAC Name
(2
E
)-3-(2-hydroxyphenyl)prop-2-enoate
Synonyms
Sources
(2
E
)-3-(2-hydroxyphenyl)acrylate
ChEBI
trans
-2-coumarate
UniProt
Registry Number
Type
Source
1342074
Gmelin Registry Number
Gmelin
Last Modified
13 November 2017