Molecule ID: 21145092

IUPAC Name: (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate

Description: The molecule is a hydroxy monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid. The major species at pH 7.3. It is a hydroxy monocarboxylic acid anion and a dioxo monocarboxylic acid anion. It is a conjugate base of a (4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid.

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

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

InChI: InChI=1S/C6H8O6/c7-2-5(10)3(8)1-4(9)6(11)12/h2-3,5,8,10H,1H2,(H,11,12)/p-1/t3-,5+/m0/s1

Molecular Properties:
- Polar Surface Area: 115.0 Ų
- LogP: -1.5