(2S)-2-amino-4-[[(1S)-1-(carboxymethylcarbamoyl)-2-(2,4-dinitrophenyl)sulfanyl-ethyl]carbamoyl]butanoic acid

Molecular Formula: C16H19N5O10S


InChI: InChI=1/C16H19N5O10S/c17-9(16(26)27)2-4-13(22)19-10(15(25)18-6-14(23)24)7-32-12-3-1-8(20(28)29)5-11(12)21(30)31/h1,3,5,9-10H,2,4,6-7,17H2,(H,18,25)(H,19,22)(H,23,24)(H,26,27)/t9-,10-/m0/s1/f/h18-19,23,26H

InChIKey: InChIKey=FXEUKVKGTKDDIQ-ZMIYAPQADI
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

Names:
    (2S)-2-amino-4-[[(1S)-1-(carboxymethylcarbamoyl)-2-(2,4-dinitrophenyl)sulfanyl-ethyl]carbamoyl]butanoic acid

Registries:
    PubChem CID 97535
    PubChem ID 10229012