EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:137761 - 3-oxo-4-pentenoic acid

ChEBI IDCHEBI:137761
ChEBI Name3-oxo-4-pentenoic acid
Stars
Last Modified11 July 2017
Submittermwilliams
DownloadsMolfile
FormulaC5H6O3
Net Charge0
Average Mass114.100
Monoisotopic Mass114.03169
SMILESC=CC(=O)CC(=O)O
InChIInChI=1S/C5H6O3/c1-2-4(6)3-5(7)8/h2H,1,3H2,(H,7,8)
InChIKeyKSSFGJUSMXZBDD-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-oxo-4-pentenoic acid (CHEBI:137761) is a oxo carboxylic acid (CHEBI:25754)
Manual XrefsDatabases
LMFA01060166LIPID MAPS