Molecule ID: 579061

IUPAC Name: 4-oxo-4-(6-oxo-1H-pyridin-3-yl)butanoic acid

Description: The molecule is a 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. It is a monohydroxypyridine, a 4-oxo monocarboxylic acid and an aromatic ketone. It derives from a succinic acid. It is a conjugate acid of a 4-(6-hydroxypyridin-3-yl)-4-oxobutyrate.

SMILES: O=C(O)CCC(=O)c1ccc(O)nc1

SELFIES: [O][=C][Branch1][C][O][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1]

InChI: InChI=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)

Molecular Properties:
- Polar Surface Area: 83.5 Ų
- LogP: -1.0