Molecule ID: 40428952

IUPAC Name: (2S)-2-(6-hydroxynaphthalen-2-yl)propanoate

Description: The molecule is a monocarboxylic acid anion that is the conjugate base of desmethylnaproxen, obtained by deprotonation of the carboxy group; major species at pH 7.3. It has a role as a drug metabolite, a human blood serum metabolite and a human urinary metabolite. It is a conjugate base of a desmethylnaproxen.

SMILES: C[C@H](C(=O)O)c1ccc2cc([O-])ccc2c1

SELFIES: [C][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Branch1][C][O-1][C][=C][C][Ring1][#Branch1][=C][Ring1][O]

InChI: InChI=1S/C13H12O3/c1-8(13(15)16)9-2-3-11-7-12(14)5-4-10(11)6-9/h2-8,14H,1H3,(H,15,16)/p-1/t8-/m0/s1

Molecular Properties:
- Polar Surface Area: 60.4 Ų
- LogP: 3.7