Molecule ID: 443424

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

Description: The molecule is the L-enantiomer of 3-oxoalanine. It has a role as an Escherichia coli metabolite. It is a 3-oxoalanine, a L-alanine derivative and a non-proteinogenic L-alpha-amino acid. It derives from a L-serine. It is a conjugate acid of a L-3-oxoalaninate. It is a tautomer of a L-3-oxoalanine zwitterion.

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

SELFIES: [N][C@@H1][Branch1][Ring1][C][=O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C3H5NO3/c4-2(1-5)3(6)7/h1-2H,4H2,(H,6,7)/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 80.4 Ų
- LogP: -3.7