Molecule ID: 333293

IUPAC Name: 2-[[2-amino-3-[[2-amino-3-(carboxymethylamino)-3-oxopropyl]disulfanyl]propanoyl]amino]acetic acid

Description: The molecule is an organic disulfide obtained by the oxidation of two Cys-Gly molecules which are then linked via a disulfide bond. It is an organic disulfide and a dipeptide. It derives from a cystine. It is a tautomer of a Cys-Gly disulfide dizwitterion.

SMILES: NC(CSSCC(N)C(O)=NCC(=O)O)C(O)=NCC(=O)O

SELFIES: [N][C][Branch2][Ring1][Ring2][C][S][S][C][C][Branch1][C][N][C][Branch1][C][O][=N][C][C][=Branch1][C][=O][O][C][Branch1][C][O][=N][C][C][=Branch1][C][=O][O]

InChI: InChI=1S/C10H18N4O6S2/c11-5(9(19)13-1-7(15)16)3-21-22-4-6(12)10(20)14-2-8(17)18/h5-6H,1-4,11-12H2,(H,13,19)(H,14,20)(H,15,16)(H,17,18)

Molecular Properties:
- Polar Surface Area: 235.0 Ų
- LogP: -7.6