CHEBI:28993 - cis-acetylacrylic acid

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ChEBI Name cis-acetylacrylic acid
ChEBI ID CHEBI:28993
ChEBI ASCII Name cis-acetylacrylic acid
Definition A 4-oxo monocarboxylic acid that is (Z)-pent-2-enoic acid in which the 4-position has been oxidised to the corresponding ketone.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10481, CHEBI:23305
Supplier Information ZINC000030726228
Download Molfile XML SDF
Formula C5H6O3
Net Charge 0
Average Mass 114.09930
Monoisotopic Mass 114.03169
InChI InChI=1S/C5H6O3/c1-4(6)2-3-5(7)8/h2-3H,1H3,(H,7,8)/b3-2-
InChIKey XGTKSWVCNVUVHG-IHWYPQMZSA-N
SMILES CC(=O)\C=C/C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cis-acetylacrylic acid (CHEBI:28993) has functional parent pent-2-enoic acid (CHEBI:35939)
cis-acetylacrylic acid (CHEBI:28993) is a 4-oxo monocarboxylic acid (CHEBI:35950)
IUPAC Name
(2Z)-4-oxopent-2-enoic acid
Synonyms Sources
(Z)-acetylacrylic acid ChEBI
cis-4-oxopent-2-enoic acid ChEBI
Manual Xrefs Databases
c0386 UM-BBD
C07091 KEGG COMPOUND
View more database links
Registry Number Type Source
1720880 Reaxys Registry Number Reaxys
Last Modified
21 February 2011