Molecule ID: 1066

IUPAC Name: pyridine-2,3-dicarboxylic acid

Description: The molecule is a pyridinedicarboxylic acid that is pyridine substituted by carboxy groups at positions 2 and 3. It is a metabolite of tryptophan. It has a role as a NMDA receptor agonist, a human metabolite, a mouse metabolite and an Escherichia coli metabolite. It is a conjugate acid of a quinolinate(1-) and a quinolinate.

SMILES: O=C(O)c1cccnc1C(=O)O

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

InChI: InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)

Molecular Properties:
- Polar Surface Area: 87.5 Ų
- LogP: 0.2