Molecule ID: 45479578

IUPAC Name: 2-hydroxy-3-(phosphomethyl)butanedioate

Description: The molecule is a dicarboxylic acid anion obtained by deprotonation of the carboxy and phosphino groups of phosphinomethylisomalic acid; major species at pH 7.3. It is a conjugate base of a phosphinomethylisomalic acid.

SMILES: O=C([O-])C(O)C(CP(=O)=O)C(=O)[O-]

SELFIES: [O][=C][Branch1][C][O-1][C][Branch1][C][O][C][Branch1][#Branch1][C][P][=Branch1][C][=O][=O][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C5H7O7P/c6-3(5(9)10)2(4(7)8)1-13(11)12/h2-3,6H,1H2,(H,7,8)(H,9,10)/p-2

Molecular Properties:
- Polar Surface Area: 141.0 Ų
- LogP: -1.6