Molecule ID: 9548603

IUPAC Name: 2-hydroxy-3-(1H-indol-3-yl)propanoate

Description: The molecule is a 2-hydroxy carboxylate that is the conjugate base of 3-(indol-3-yl)lactic acid. It has a role as a human metabolite. It derives from a lactate. It is a conjugate base of a 3-(indol-3-yl)lactic acid.

SMILES: O=C([O-])C(O)Cc1c[nH]c2ccccc12

SELFIES: [O][=C][Branch1][C][O-1][C][Branch1][C][O][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]

InChI: InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15)/p-1

Molecular Properties:
- Polar Surface Area: 76.2 Ų
- LogP: 2.1