N,N’-Didescarboxymethyl Daclatasvir-d8

分析物名称

N,N'-Didescarboxymethyl Daclatasvir-d8

分子式

C36 D16 H30 N8 O2

分子量

638.901

精确质量测定

638.475

SMILES

[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])[C@@]([2H])(N)C(=O)N1CCC[C@H]1c2ncc([nH]2)c3ccc(cc3)c4ccc(cc4)c5cnc([nH]5)[C@@H]6CCCN6C(=O)C([2H])(N)C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]

InChI

InChI=1S/C36H46N8O2/c1-21(2)31(37)35(45)43-17-5-7-29(43)33-39-19-27(41-33)25-13-9-23(10-14-25)24-11-15-26(16-12-24)28-20-40-34(42-28)30-8-6-18-44(30)36(46)32(38)22(3)4/h9-16,19-22,29-32H,5-8,17-18,37-38H2,1-4H3,(H,39,41)(H,40,42)/t29-,30-,31+,32?/m0/s1/i1D3,2D3,3D3,4D3,21D,22D,31D,32D

IUPAC

2-amino-1-[(2S)-2-[5-[4-[4-[2-[(2S)-1-[(2R)-2-amino-2,3,4,4,4-pentadeuterio-3-(trideuteriomethyl)butanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2,3,4,4,4-pentadeuterio-3-(trideuteriomethyl)butan-1-one

SIL类型

Deuterium

运输温度

Room Temperature

原产国

CANADA

产品形式

Neat