Molecule ID: 5852

IUPAC Name: (2S)-2-amino-3-methyl-3-sulfanylbutanoic acid

Description: The molecule is an optically active form of penicillamine having D-configuration. Pharmaceutical form (L-form is toxic) of chelating agent used to treat heavy metal poisoning. It has a role as a chelator, an antirheumatic drug and a drug allergen. It is a penicillamine and a non-proteinogenic alpha-amino acid. It is an enantiomer of a L-penicillamine.

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

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

InChI: InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 64.3 Ų
- LogP: -1.8