Molecule ID: 40468139

IUPAC Name: (2R,3R)-2-azaniumyl-3-hydroxybutanedioate

Description: The molecule is a D-alpha-amino acid anion which is obtained from (3R)-3-hydroxy-D-aspartic acid by formal deprotonation of both carboxyl groups and protonation of the amino group. It is a D-alpha-amino acid anion and a dicarboxylic acid anion. It is a conjugate base of a (3R)-3-hydroxy-D-aspartic acid. It is an enantiomer of a (3S)-3-hydroxy-L-aspartate(1-).

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

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

InChI: InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/p-1/t1-,2-/m1/s1

Molecular Properties:
- Polar Surface Area: 128.0 Ų
- LogP: -3.1