Molecule ID: 25201352

IUPAC Name: (2R)-2,4-dihydroxy-3-oxobutanoate

Description: The molecule is the conjugate base of 3-dehydro-L-threonic acid; major species at pH 7.3. It is a hydroxy monocarboxylic acid anion and a 3-oxo monocarboxylic acid anion. It is a conjugate base of a (R)-2,4-dihydroxy-3-oxobutanoic acid. It is an enantiomer of a (S)-2,4-dihydroxy-3-oxobutanoate.

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

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

InChI: InChI=1S/C4H6O5/c5-1-2(6)3(7)4(8)9/h3,5,7H,1H2,(H,8,9)/p-1/t3-/m1/s1

Molecular Properties:
- Polar Surface Area: 97.7 Ų
- LogP: -0.9