CHEBI:140633 - 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate
ChEBI ID CHEBI:140633
Definition A pyridinemonocarboxylate resulting from the deprotonation of the carboxy group of 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid. The major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C8H6NO4
Net Charge -1
Average Mass 180.140
Monoisotopic Mass 180.03023
InChI InChI=1S/C8H7NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2-3,11H,1H3,(H,12,13)/p-1
InChIKey JTWNWNJMNSJYDL-UHFFFAOYSA-M
SMILES C1(=CN=C(C(=C1C(=O)[O-])O)C)C=O
ChEBI Ontology
Outgoing 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate (CHEBI:140633) is a pyridinemonocarboxylate (CHEBI:38181)
5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate (CHEBI:140633) is conjugate base of 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid (CHEBI:28038)
Incoming 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid (CHEBI:28038) is conjugate acid of 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate (CHEBI:140633)
Synonym Source
5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate UniProt
Manual Xrefs Databases
C06050 KEGG COMPOUND
CPD-9026 MetaCyc
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Citations Waiting for Citations Types Sources
18216065 PubMed citation SUBMITTER
6348042 PubMed citation SUBMITTER
Last Modified
29 January 2020