Analyte Name

3'-De(phosphinicooxy)guanylyl-1H-1,2,3-triazole-1,4-diyl-(3'-5')-2',5'-dideoxy-guanosine

CAS Number

1513874-09-3

Molecular Formula

C22 H25 N13 O7

Molecular Weight

583.517

Accurate Mass

583.2

SMILES

NC1=Nc2c(ncn2[C@H]3C[C@H](O)[C@@H](Cc4cn(nn4)[C@@H]5[C@@H](CO)O[C@H]([C@@H]5O)n6cnc7C(=O)NC(=Nc67)N)O3)C(=O)N1

InChI

InChI=1S/C22H25N13O7/c23-21-27-16-12(18(39)29-21)25-5-33(16)11-2-8(37)9(41-11)1-7-3-35(32-31-7)14-10(4-36)42-20(15(14)38)34-6-26-13-17(34)28-22(24)30-19(13)40/h3,5-6,8-11,14-15,20,36-38H,1-2,4H2,(H3,23,27,29,39)(H3,24,28,30,40)/t8-,9+,10+,11+,14+,15+,20+/m0/s1

IUPAC

2-amino-9-[(2R,4S,5R)-5-[[1-[(2S,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]triazol-4-yl]methyl]-4-hydroxyoxolan-2-yl]-1H-purin-6-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat