Lopinavir-d8

Analyte Name

Lopinavir alphyl,methylethyl-d8

CAS Number

1322625-54-6

Molecular Formula

C37 D8 H40 N4 O5

Molecular Weight

636.85

Accurate Mass

636.4127

SMILES

[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])[C@]([2H])(N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](Cc2ccccc2)NC(=O)COc3c(C)cccc3C)Cc4ccccc4

InChI

InChI=1S/C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t30-,31-,32-,34-/m0/s1/i1D3,2D3,25D,34D

IUPAC

(2S)-N-[(1S,3S,4S)-1-benzyl-4-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-pentyl]-2,3,4,4,4-pentadeuterio-2-(2-oxohexahydropyrimidin-1-yl)-3-(trideuteriomethyl)butanamide

Unlabelled CAS Number

192725-17-0

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Lopinavir

Purity

>95% (HPLC)