Molecule ID: 21145376

IUPAC Name: (2R,3R)-2,3-dihydroxy-3-methylpentanoate

Description: The molecule is a hydroxy monocarboxylic acid anion. It has a role as a Saccharomyces cerevisiae metabolite. It derives from a valerate. It is a conjugate base of a (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid.

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

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

InChI: InChI=1S/C6H12O4/c1-3-6(2,10)4(7)5(8)9/h4,7,10H,3H2,1-2H3,(H,8,9)/p-1/t4-,6+/m0/s1

Molecular Properties:
- Polar Surface Area: 80.6 Ų
- LogP: 0.3