Molecule ID: 45266521

IUPAC Name: (2R)-2-hydroxy-3-(5-phenylmethoxy-1H-indol-3-yl)propanoic acid

Description: The molecule is a propanoic acid derivative having an (R)-hydroxy substituent at the 2-position and a 5-benzyloxy-1H-indol-3-yl group at the 3-position. It derives from a propionic acid and a 1H-indole. It is a conjugate acid of a (R)-3-(5-benzyloxyindol-3-yl)lactate.

SMILES: O=C(O)[C@H](O)Cc1c[nH]c2ccc(OCc3ccccc3)cc12

SELFIES: [O][=C][Branch1][C][O][C@H1][Branch1][C][O][C][C][=C][NH1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][P][Ring1][=C]

InChI: InChI=1S/C18H17NO4/c20-17(18(21)22)8-13-10-19-16-7-6-14(9-15(13)16)23-11-12-4-2-1-3-5-12/h1-7,9-10,17,19-20H,8,11H2,(H,21,22)/t17-/m1/s1

Molecular Properties:
- Polar Surface Area: 82.6 Ų
- LogP: 3.2