Molecule ID: 72886

IUPAC Name: (2R)-2-amino-3-sulfopropanoic acid

Description: The molecule is the L-enantiomer of cysteic acid. It has a role as an Escherichia coli metabolite and a human metabolite. It is a cysteic acid, an amino sulfonic acid, a L-alanine derivative, a L-cysteine derivative and a non-proteinogenic L-alpha-amino acid. It is a conjugate acid of a L-cysteate(1-).

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

SELFIES: [N][C@@H1][Branch1][#Branch2][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C3H7NO5S/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 126.0 Ų
- LogP: -4.5