EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:58222 - 4-hydroxy-2-oxopentanoate

ChEBI IDCHEBI:58222
ChEBI Name4-hydroxy-2-oxopentanoate
Stars
DefinitionA 2-oxo monocarboxylic acid corresponding to the conjugate base of 4-hydroxy-2-oxopentanoic acid; major species at pH 7.3.
Last Modified14 July 2014
DownloadsMolfile
FormulaC5H7O4
Net Charge-1
Average Mass131.107
Monoisotopic Mass131.03498
SMILESCC(O)CC(=O)C(=O)[O-]
InChIInChI=1S/C5H8O4/c1-3(6)2-4(7)5(8)9/h3,6H,2H2,1H3,(H,8,9)/p-1
InChIKeyHFKQINMYQUXOCH-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-2-oxopentanoate (CHEBI:58222) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
4-hydroxy-2-oxopentanoate (CHEBI:58222) is a oxo monocarboxylic acid anion (CHEBI:35902)
4-hydroxy-2-oxopentanoate (CHEBI:58222) is conjugate base of 4-hydroxy-2-oxopentanoic acid (CHEBI:17655)
Incoming Relation(s)
(S)-4-hydroxy-2-oxopentanoate (CHEBI:73143) is a 4-hydroxy-2-oxopentanoate (CHEBI:58222)
4-hydroxy-2-oxopentanoic acid (CHEBI:17655) is conjugate acid of 4-hydroxy-2-oxopentanoate (CHEBI:58222)
IUPAC Name 
4-hydroxy-2-oxopentanoate
UniProt Name  Source
4-hydroxy-2-oxopentanoateUniProt