Molecule ID: 6857538

IUPAC Name: (2S)-2-amino-3-[[(2S)-2-amino-2-carboxyethyl]disulfanyl]propanoic acid

Description: The molecule is the D-enantiomer of cystine. It has a role as an EC 1.2.1.12 (aspartate-semialdehyde dehydrogenase) inhibitor. It is an enantiomer of a L-cystine. It is a tautomer of a D-cystine zwitterion.

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

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

InChI: InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m1/s1

Molecular Properties:
- Polar Surface Area: 177.0 Ų
- LogP: -6.3