Molecule ID: 44123319

IUPAC Name: (2R)-2-hydroxyhexane-1,2,6-tricarboxylate

Description: The molecule is a tricarboxylic acid trianion obtained by deprotonation of the three carboxy groups of (2R)-trihomocitric acid; major species at pH 7.3. It is a conjugate base of a (2R)-trihomocitric acid.

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

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

InChI: InChI=1S/C9H14O7/c10-6(11)3-1-2-4-9(16,8(14)15)5-7(12)13/h16H,1-5H2,(H,10,11)(H,12,13)(H,14,15)/p-3/t9-/m1/s1

Molecular Properties:
- Polar Surface Area: 141.0 Ų
- LogP: 1.0