Analyte Name

2'-Deoxy-8-((2-(1H-imidazol-4-yl)ethyl)amino)adenosine 5'-(Tetrahydrogen Triphosphate)

CAS Number

233758-46-8

Molecular Formula

C15 H23 N8 O12 P3

Molecular Weight

600.311

Accurate Mass

600.065

SMILES

Nc1ncnc2c1nc(NCCc3c[nH]cn3)n2[C@H]4C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O4

InChI

InChI=1S/C15H23N8O12P3/c16-13-12-14(21-7-20-13)23(15(22-12)18-2-1-8-4-17-6-19-8)11-3-9(24)10(33-11)5-32-37(28,29)35-38(30,31)34-36(25,26)27/h4,6-7,9-11,24H,1-3,5H2,(H,17,19)(H,18,22)(H,28,29)(H,30,31)(H2,16,20,21)(H2,25,26,27)/t9-,10+,11+/m0/s1

IUPAC

[[(2R,3S,5R)-5-[6-amino-8-[2-(1H-imidazol-4-yl)ethylamino]purin-9-yl]-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat