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CHEBI:66946 - 4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid

ChEBI IDCHEBI:66946
ChEBI Name4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid
Stars
DefinitionA 4-oxo monocarboxylic acid that is succinic acid in which one of the carboxyl hydroxy groups is substituted by a 6-hydroxypyridin-3-yl group.
Last Modified7 November 2013
SubmitterSteve
DownloadsMolfile
FormulaC9H9NO4
Net Charge0
Average Mass195.174
Monoisotopic Mass195.05316
SMILESO=C(O)CCC(=O)c1ccc(O)nc1
InChIInChI=1S/C9H9NO4/c11-7(2-4-9(13)14)6-1-3-8(12)10-5-6/h1,3,5H,2,4H2,(H,10,12)(H,13,14)
InChIKeyOMAJIMAYOJBLJF-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)
4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946) has functional parent succinic acid (CHEBI:15741)
4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946) is a 4-oxo monocarboxylic acid (CHEBI:35950)
4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946) is a aromatic ketone (CHEBI:76224)
4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946) is a monohydroxypyridine (CHEBI:38182)
4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946) is conjugate acid of 4-(6-hydroxypyridin-3-yl)-4-oxobutyrate (CHEBI:66893)
Incoming Relation(s)
4-(6-hydroxypyridin-3-yl)-4-oxobutyrate (CHEBI:66893) is conjugate base of 4-(6-hydroxypyridin-3-yl)-4-oxobutyric acid (CHEBI:66946)
IUPAC Name 
4-(6-hydroxypyridin-3-yl)-4-oxobutanoic acid
Synonym  Source
6-hydroxy-3-succinoylpyridineMetaCyc
Manual XrefsDatabases
CPD-14096MetaCyc
Registry NumbersSources
Reaxys:170790Reaxys
Citations