Molecule ID: 7098638

IUPAC Name: (2S)-2-azaniumyl-4-dimethylsulfoniobutanoate

Description: The molecule is a sulfonium compound that is a tautomer of S-methyl-L-methionine, arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3. It is a tautomer of a S-methyl-L-methionine.

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

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

InChI: InChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/p+1/t5-/m0/s1

Molecular Properties:
- Polar Surface Area: 68.8 Ų
- LogP: -1.7