Analyte Name

(2S,3S,5S)-5-Amino-1,6-diphenyl-2-(((thiazol-5-ylmethoxy)carbonyl)amino)hexan-3-yl 2-(3-((2-isopropylthiazol-4-yl)methyl)-3-methylureido)-3-methylbutanoate Hydrochloride-d6

Molecular Formula

C37 D6 H42 N6 O5 S2 . H Cl

Molecular Weight

763.442

Accurate Mass

762.327

SMILES

Cl.[2H]C([2H])([2H])C(c1nc(CN(C)C(=O)N[C@@H](C(C)C)C(=O)O[C@@H](C[C@@H](N)Cc2ccccc2)[C@H](Cc3ccccc3)NC(=O)OCc4cncs4)cs1)C([2H])([2H])[2H]

InChI

InChI=1S/C37H48N6O5S2.ClH/c1-24(2)33(42-36(45)43(5)20-29-22-49-34(40-29)25(3)4)35(44)48-32(18-28(38)16-26-12-8-6-9-13-26)31(17-27-14-10-7-11-15-27)41-37(46)47-21-30-19-39-23-50-30;/h6-15,19,22-25,28,31-33H,16-18,20-21,38H2,1-5H3,(H,41,46)(H,42,45);1H/t28-,31-,32-,33-;/m0./s1/i3D3,4D3;

IUPAC

[(2S,3S,5S)-5-amino-1,6-diphenyl-2-(1,3-thiazol-5-ylmethoxycarbonylamino)hexan-3-yl] (2S)-2-[[[2-(1,1,1,3,3,3-hexadeuteriopropan-2-yl)-1,3-thiazol-4-yl]methyl-methylcarbamoyl]amino]-3-methylbutanoate;hydrochloride

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat