Molecule ID: 2724505

IUPAC Name: (2S)-2-amino-4-phenylbutanoic acid

Description: The molecule is a non-proteinogenic L-alpha-amino acid that is an analogue of L-phenylalanine having a 2-phenylethyl rather than a benzyl side-chain. It has a role as a bacterial metabolite.

SMILES: N[C@@H](CCc1ccccc1)C(=O)O

SELFIES: [N][C@@H1][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C10H13NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 63.3 Ų
- LogP: -1.2