Molecule ID: 558882

IUPAC Name: 2-hydroxy-3-methylbutanedioic acid

Description: The molecule is a dicarboxylic acid that is succinic acid carrying hydroxy and methyl substituents at positions 2 and 3 respectively It has a role as a human metabolite. It derives from a succinic acid. It is a conjugate acid of a 3-methylmalate(2-).

SMILES: CC(C(=O)O)C(O)C(=O)O

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

InChI: InChI=1S/C5H8O5/c1-2(4(7)8)3(6)5(9)10/h2-3,6H,1H3,(H,7,8)(H,9,10)

Molecular Properties:
- Polar Surface Area: 94.8 Ų
- LogP: -0.8