CHEBI:16685 - 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid
ChEBI ID CHEBI:16685
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:20524, CHEBI:2016, CHEBI:12088
Supplier Information
Download Molfile XML SDF
Formula C10H7NO7
Net Charge 0
Average Mass 253.16512
Monoisotopic Mass 253.02225
InChI InChI=1S/C10H7NO7/c12-6(10(17)18)2-1-4-7(13)3-5(9(15)16)11-8(4)14/h1-3H,(H,15,16)(H,17,18)(H2,11,13,14)
InChIKey ATWKTZAAIUROID-UHFFFAOYSA-N
SMILES [H]C(=CC(=O)C(O)=O)c1c(O)cc(nc1O)C(O)=O
ChEBI Ontology
Outgoing 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid (CHEBI:16685) has functional parent oxalic acid (CHEBI:16995)
5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid (CHEBI:16685) has functional parent picolinic acid (CHEBI:28747)
5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid (CHEBI:16685) is a dihydroxypyridine (CHEBI:23793)
5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid (CHEBI:16685) is conjugate acid of 5-(3-carboxylato-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylate (CHEBI:57859)
Incoming 5-(3-carboxylato-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylate (CHEBI:57859) is conjugate base of 5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylic acid (CHEBI:16685)
IUPAC Name
5-(3-carboxy-3-oxoprop-1-en-1-yl)-4,6-dihydroxypyridine-2-carboxylic acid
Synonym Source
5-(3-Carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylate KEGG COMPOUND
Manual Xref Database
C04826 KEGG COMPOUND
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Last Modified
02 September 2008