EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:144867 - 6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate

Default Structure
ChEBI IDCHEBI:144867
ChEBI Name6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate
Stars
DefinitionAn enolate anion resulting from the deprotonation of the hydroxy group of 6-chloro-3-hydroxypyridine-2,5-dione. The major species at pH 7.3.
Last Modified18 September 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC5HClNO3
Net Charge-1
Average Mass158.520
Monoisotopic Mass157.96504
SMILESO=C1C=C([O-])C(=O)N=C1Cl
InChIInChI=1S/C5H2ClNO3/c6-4-2(8)1-3(9)5(10)7-4/h1,9H/p-1
InChIKeyUHSNLTHAMWTIQQ-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate (CHEBI:144867) is a enolate (CHEBI:142839)
6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate (CHEBI:144867) is conjugate base of 6-chloro-3-hydroxypyridine-2,5-dione (CHEBI:144888)
Incoming Relation(s)
6-chloro-3-hydroxypyridine-2,5-dione (CHEBI:144888) is conjugate acid of 6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate (CHEBI:144867)
IUPAC Name 
6-chloro-2,5-dioxo-2,5-dihydropyridin-3-olate
Synonyms  Source
6-chloro-2,5-dioxo-2,5-dihydropyridin-3-ol(1−)ChEBI
6-chloro-3-hydroxypyridine-2,5-dione(1−)ChEBI
UniProt Name  Source
6-chloro-3-hydroxypyridine-2,5-dioneUniProt
Manual XrefsDatabases
CPD-16807MetaCyc
Citations