Molecule ID: 7349658

IUPAC Name: (2S,3R)-2-acetamido-3-hydroxybutanoate

Description: The molecule is a monocarboxylic acid anion that is the conjugate base of N-acetyl-L-threonine, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a monocarboxylic acid anion and a N-acyl-L-alpha-amino acid anion. It is a conjugate base of a N-acetyl-L-threonine.

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

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

InChI: InChI=1S/C6H11NO4/c1-3(8)5(6(10)11)7-4(2)9/h3,5,8H,1-2H3,(H,7,9)(H,10,11)/p-1/t3-,5+/m1/s1

Molecular Properties:
- Polar Surface Area: 89.5 Ų
- LogP: -0.3