Molecule ID: 5460881

IUPAC Name: (2S)-2,4-diamino-4-oxobutanoate

Description: The molecule is an optically active form of asparaginate having L-configuration. It is an asparaginate and a L-alpha-amino acid anion. It is a conjugate base of a L-asparagine. It is an enantiomer of a D-asparaginate.

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

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

InChI: InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/p-1/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 109.0 Ų
- LogP: -2.8