CHEBI:59354 - (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid

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ChEBI Name (3E)-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.
Supplier Information
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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 (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (CHEBI:59354) has functional parent pyruvic acid (CHEBI:32816)
(3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (CHEBI:59354) is a 2-oxo monocarboxylic acid (CHEBI:35910)
(3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (CHEBI:59354) is conjugate acid of (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate (CHEBI:59353)
Incoming (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate (CHEBI:59353) is conjugate base of (3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid (CHEBI:59354)
IUPAC Name
(3E)-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