Molecule ID: 3316652

IUPAC Name: 6-hydroxy-6-oxohexanoate

Description: The molecule is a dicarboxylic acid monoanion that is the conjugate base of adipic acid. It has a role as a human xenobiotic metabolite. It is a conjugate base of an adipic acid. It is a conjugate acid of an adipate(2-).

SMILES: O=C([O-])CCCCC(=O)O

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

InChI: InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 77.4 Ų
- LogP: 0.7