(2R)-2-[(tert-butoxycarbonyl)amino]-3-{[(2R)-2-[(tert-butoxycarbonyl)amino]-2-carboxyethyl]disulfanyl}propanoic acid

CAS: 10389-65-8

Formula: C16H28N2O8S2

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

IUPAC: (2R)-2-{[(tert-butoxy)carbonyl]amino}-3-{[(2R)-2-{[(tert-butoxy)carbonyl]amino}-2-carboxyethyl]disulfanyl}propanoic acid

InChI: InChI=1S/C16H28N2O8S2/c1-15(2,3)25-13(23)17-9(11(19)20)7-27-28-8-10(12(21)22)18-14(24)26-16(4,5)6/h9-10H,7-8H2,1-6H3,(H,17,23)(H,18,24)(H,19,20)(H,21,22)/t9-,10-/m0/s1

Composition: C (43.62%), H (6.41%), N (6.36%), O (29.05%), S (14.56%)

Molar Mass: 440.53

Atom Count: 56

Heavy Atom Count: 28