Molecule ID: 255720

IUPAC Name: 2-amino-3-methoxybenzoic acid

Description: The molecule is an aminobenzoic acid that is anthranilic acid in which the hydrogen at position 3 is substituted by a methoxy group. It is a metabolite of kynurenine. It has a role as a mammalian metabolite. It is a member of benzoic acids and an aminobenzoic acid. It derives from an anthranilic acid. It is a conjugate acid of a 3-methoxyanthranilate.

SMILES: COc1cccc(C(=O)O)c1N

SELFIES: [C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][N]

InChI: InChI=1S/C8H9NO3/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4H,9H2,1H3,(H,10,11)

Molecular Properties:
- Polar Surface Area: 72.6 Ų
- LogP: 1.6