Analyte Name

N,N’-Bisboc N,N'-L-Cystinyldiglycine-13C4,15N2 Dibenzyl Ester

Molecular Formula

13C4 C30 H46 15N2 N2 O10 S2

Molecular Weight

740.837

Accurate Mass

740.273

SMILES

CC(C)(C)OC(=O)N[C@@H](CSSC[C@@H](NC(=O)OC(C)(C)C)C(=O)[15NH][13CH2][13C](=O)OCc1ccccc1)C(=O)[15NH][13CH2][13C](=O)OCc2ccccc2

InChI

InChI=1S/C34H46N4O10S2/c1-33(2,3)47-31(43)37-25(29(41)35-17-27(39)45-19-23-13-9-7-10-14-23)21-49-50-22-26(38-32(44)48-34(4,5)6)30(42)36-18-28(40)46-20-24-15-11-8-12-16-24/h7-16,25-26H,17-22H2,1-6H3,(H,35,41)(H,36,42)(H,37,43)(H,38,44)/t25-,26+/i17+1,18+1,27+1,28+1,35+1,36+1

IUPAC

benzyl 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-[(2-oxo-2-phenylmethoxy(1,2-13C2)ethyl)(15N)amino]propyl]disulfanyl]propanoyl](15N)amino]acetate

SIL Type

Nitrogen, Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat