Analyte Name

Boc-Pen (NPys)-OH

CAS Number

250375-03-2

Molecular Formula

C15 H21 N3 O6 S2

Molecular Weight

403.474

Accurate Mass

403.087

SMILES

CC(C)(C)OC(=O)N[C@H](C(=O)O)C(C)(C)SSc1ncccc1[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O6S2/c1-14(2,3)24-13(21)17-10(12(19)20)15(4,5)26-25-11-9(18(22)23)7-6-8-16-11/h6-8,10H,1-5H3,(H,17,21)(H,19,20)/t10-/m1/s1

IUPAC

(2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3-nitropyridin-2-yl)disulfanyl]butanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat