Molecule ID: 6992002

IUPAC Name: (2R)-2-azaniumyl-3-(carboxylatomethylsulfanyl)propanoate

Description: The molecule is the conjugate base of S-carboxymethyl-L-cysteine having anionic carboxy groups and a protonated amino group; major species at pH 7.3. It is an alpha-amino-acid anion and a dicarboxylic acid anion. It is a conjugate base of a S-carboxymethyl-L-cysteine.

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

SELFIES: [N][C@@H1][Branch1][=Branch2][C][S][C][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C5H9NO4S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 133.0 Ų
- LogP: -1.8