Molecule ID: 50986246

IUPAC Name: (5S)-5-hydroxy-2,4-dioxohexanoic acid

Description: The molecule is a ketoaldonic acid that is rhamnonic acid which is lacking the 3-hydroxy group, while those at positions 2 and 4 have been oxidised to the corresponding ketones. It has a role as a bacterial metabolite. It is a hexonic acid and a ketoaldonic acid. It derives from a rhamnonic acid. It is a conjugate acid of a 2,4-didehydro-3-deoxy-L-rhamnonate.

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

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

InChI: InChI=1S/C6H8O5/c1-3(7)4(8)2-5(9)6(10)11/h3,7H,2H2,1H3,(H,10,11)/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 91.7 Ų
- LogP: -0.7