Molecule ID: 24892801

IUPAC Name: (2R)-2-hydroxypentane-1,2,5-tricarboxylic acid

Description: The molecule is a chiral tricarboxylic acid in which a central carbon carries hydroxy, carboxy, carboxymethyl and 3-carboxypropyl substituents with R-configuration at the chiral centre. It is a tricarboxylic acid and a tertiary alcohol. It is a conjugate acid of a (2R)-dihomocitrate(3-).

SMILES: O=C(O)CCC[C@@](O)(CC(=O)O)C(=O)O

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

InChI: InChI=1S/C8H12O7/c9-5(10)2-1-3-8(15,7(13)14)4-6(11)12/h15H,1-4H2,(H,9,10)(H,11,12)(H,13,14)/t8-/m1/s1

Molecular Properties:
- Polar Surface Area: 132.0 Ų
- LogP: -1.3