Molecule ID: 5460541

IUPAC Name: (2S)-2-aminobutanedioate

Description: The molecule is an aspartate(2-) that is the conjugate base of L-aspartate(1-). It has a role as a fundamental metabolite. It is an aspartate(2-) and a L-alpha-amino acid anion. It is a conjugate base of a L-aspartate(1-). It is an enantiomer of a D-aspartate(2-).

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

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

InChI: InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-2/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 106.0 Ų
- LogP: -2.6