Molecule ID: 151805

IUPAC Name: (2S,3S,4S)-2,3,4,6-tetrahydroxy-5-oxohexanoic acid

Description: The molecule is the straight-chain keto form of D-fructuronic acid. It derives from a keto-D-fructose. It is a conjugate acid of a keto-D-fructuronate.

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

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

InChI: InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-5,7,9-11H,1H2,(H,12,13)/t3-,4+,5+/m1/s1

Molecular Properties:
- Polar Surface Area: 135.0 Ų
- LogP: -3.0