Molecule ID: 1745307

IUPAC Name: (2S)-2-(carbamoylamino)-4-methylsulfanylbutanoate

Description: The molecule is an N-carbamoyl-L-alpha-amino acid anion obtained by deprotonation of the carboxy group of N-carbamoyl-L-methionine. Major microspecies at pH 7.3. It is a conjugate base of a N-carbamoyl-L-methionine. It is an enantiomer of a N-carbamoyl-D-methioninate.

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

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

InChI: InChI=1S/C6H12N2O3S/c1-12-3-2-4(5(9)10)8-6(7)11/h4H,2-3H2,1H3,(H,9,10)(H3,7,8,11)/p-1/t4-/m0/s1

Molecular Properties:
- Polar Surface Area: 121.0 Ų
- LogP: 0.1