Molecule ID: 440033

IUPAC Name: (2S)-2-amino-3-oxobutanoic acid

Description: The molecule is a 2-amino-3-oxobutanoic acid and a non-proteinogenic L-alpha-amino acid. It has a role as a human metabolite and a Saccharomyces cerevisiae metabolite. It is a conjugate acid of a L-2-amino-3-oxobutanoate. It is a tautomer of a L-2-amino-3-oxobutanoic acid zwitterion.

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

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

InChI: InChI=1S/C4H7NO3/c1-2(6)3(5)4(7)8/h3H,5H2,1H3,(H,7,8)/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 80.4 Ų
- LogP: -3.4