Molecule ID: 3541112

IUPAC Name: 3-hydroxybutanoate

Description: The molecule is a hydroxy fatty acid anion that is the conjugate base of 3-hydroxybutyric acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. It has a role as a human metabolite. It derives from a butyrate. It is a conjugate base of a 3-hydroxybutyric acid.

SMILES: CC(O)CC(=O)[O-]

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

InChI: InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/p-1

Molecular Properties:
- Polar Surface Area: 60.4 Ų
- LogP: 0.1