Molecule ID: 3080614

IUPAC Name: 2-(carboxymethylamino)-2-oxoacetic acid

Description: The molecule is an amino dicarboxylic acid that is iminodiacetic acid with an oxo substituent. It is used as an inhibitor of alpha-ketoglutarate dependent (EC 1.14.11.*) enzymes. It has a role as an EC 1.14.11.* (oxidoreductase acting on paired donors, 2-oxoglutarate as one donor, incorporating 1 atom each of oxygen into both donors) inhibitor. It is an amino dicarboxylic acid and a N-acylglycine.

SMILES: O=C(O)CNC(=O)C(=O)O

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

InChI: InChI=1S/C4H5NO5/c6-2(7)1-5-3(8)4(9)10/h1H2,(H,5,8)(H,6,7)(H,9,10)

Molecular Properties:
- Polar Surface Area: 104.0 Ų
- LogP: -0.9