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ChEBI
> Main
CHEBI:59354 - (3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid
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ChEBI Name
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid
ChEBI ID
CHEBI:59354
ChEBI ASCII Name
(3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid
Definition
A pyruvic acid derivative having a 2-hydroxybenzylidene group attached at the 3-position and
E
-stereochemistry.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C10H8O4
Net Charge
0
Average Mass
192.16810
Monoisotopic Mass
192.04226
InChI
InChI=1S/C10H8O4/c11-8-4-2-1-3-7(8)5-6-9(12)10(13)14/h1-6,11H,(H,13,14)/b6-5+
InChIKey
HMXOGGUFCBUALL-AATRIKPKSA-N
SMILES
OC(=O)C(=O)\C=C\c1ccccc1O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:59354
)
has functional parent
pyruvic acid (
CHEBI:32816
)
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:59354
)
is a
2-oxo monocarboxylic acid (
CHEBI:35910
)
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:59354
)
is conjugate acid of
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate (
CHEBI:59353
)
Incoming
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate (
CHEBI:59353
)
is conjugate base of
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (
CHEBI:59354
)
IUPAC Name
(3
E
)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid
Synonyms
Sources
(3E)-4-(2-Hydroxyphenyl)-2-oxobut-3-enoate
KEGG COMPOUND
2-Hydroxybenzalpyruvate
ChemIDplus
4-(2-Hydroxyphenyl)-2-oxo-3-butenoic acid
ChemIDplus
ortho-Hydroxybenzalpyruvate
ChemIDplus
Manual Xrefs
Databases
C06203
KEGG COMPOUND
DB08636
DrugBank
View more database links
Registry Numbers
Types
Sources
2692063
Beilstein Registry Number
Beilstein
90293-62-2
CAS Registry Number
ChemIDplus
Last Modified
28 July 2014