Molecule ID: 46878460

IUPAC Name: (2S,3S)-2-hydroxybutane-1,2,3-tricarboxylate

Description: The molecule is trianion arising from deprotonation of all three carboxylic acid groups of (2S,3S)-2-methylcitric acid. It is a conjugate base of a (2S,3S)-2-methylcitric acid.

SMILES: C[C@H](C(=O)[O-])[C@@](O)(CC(=O)[O-])C(=O)[O-]

SELFIES: [C][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O-1][C@@][Branch1][C][O][Branch1][#Branch1][C][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C7H10O7/c1-3(5(10)11)7(14,6(12)13)2-4(8)9/h3,14H,2H2,1H3,(H,8,9)(H,10,11)(H,12,13)/p-3/t3-,7+/m1/s1

Molecular Properties:
- Polar Surface Area: 141.0 Ų
- LogP: 0.5