分析物名称

4'-Raloxifene-beta-D-glucopyranoside-d4

分子式

C34H33D4NO9S

分子量

639.75

精确质量测定

639.24

SMILES

OC1=CC=C2C(SC(C3=CC=C(C=C3)O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO)=C2C(C5=CC=C(C=C5)OC([2H])(C([2H])(N6CCCCC6)[2H])[2H])=O)=C1

InChI

InChI=1S/C34H37NO9S/c36-19-26-30(39)31(40)32(41)34(44-26)43-24-11-6-21(7-12-24)33-28(25-13-8-22(37)18-27(25)45-33)29(38)20-4-9-23(10-5-20)42-17-16-35-14-2-1-3-15-35/h4-13,18,26,30-32,34,36-37,39-41H,1-3,14-17,19H2/t26-,30-,31+,32-,34-/m1/s1/i16D2,17D2

IUPAC

(6-hydroxy-2-(4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)benzo[b]thiophen-3-yl)(4-(2-(piperidin-1-yl)ethoxy-1,1,2,2-d4)phenyl)methanone

备用CAS登记号

1279033-52-1

无标签CAS登记号

334758-19-9

SIL类型

Deuterium

运输温度

Room Temperature

原产国

CANADA

产品形式

Neat