Analyte Name

VER 155008

CAS Number

1134156-31-2

Molecular Formula

C25H23Cl2N7O4

Molecular Weight

556.4

Accurate Mass

555.12

SMILES

NC1=NC=NC2=C1N=C(N2[C@H]3[C@@H]([C@@H]([C@H](O3)COCC4=CC=C(C=C4)C#N)O)O)NCC5=CC=C(C(Cl)=C5)Cl

InChI

InChI=1S/C25H23Cl2N7O4/c26-16-6-5-15(7-17(16)27)9-30-25-33-19-22(29)31-12-32-23(19)34(25)24-21(36)20(35)18(38-24)11-37-10-14-3-1-13(8-28)2-4-14/h1-7,12,18,20-21,24,35-36H,9-11H2,(H,30,33)(H2,29,31,32)/t18-,20-,21-,24-/m1/s1

IUPAC

4-((((2R,3S,4R,5R)-5-(6-amino-8-((3,4-dichlorobenzyl)amino)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)methyl)benzonitrile

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive Small Molecule

Product Format

Neat