Analyte Name

2-Chloro-N-trifluoroacetyl-2',3'-ditrifluoracetly-5'-adenylic Acid Trifluoroacetyl Ester

Molecular Formula

C18 H9 Cl F12 N5 O11 P

Molecular Weight

765.699

Accurate Mass

764.953

SMILES

OP(=O)(OC[C@H]1O[C@H]([C@H](OC(=O)C(F)(F)F)[C@@H]1OC(=O)C(F)(F)F)n2cnc3c(NC(=O)C(F)(F)F)nc(Cl)nc23)OC(=O)C(F)(F)F

InChI

InChI=1S/C18H9ClF12N5O11P/c19-14-34-7(33-10(37)15(20,21)22)4-8(35-14)36(2-32-4)9-6(46-12(39)17(26,27)28)5(45-11(38)16(23,24)25)3(44-9)1-43-48(41,42)47-13(40)18(29,30)31/h2-3,5-6,9H,1H2,(H,41,42)(H,33,34,35,37)/t3-,5-,6-,9-/m1/s1

IUPAC

[(2R,3R,4R,5R)-5-[2-chloro-6-[(2,2,2-trifluoroacetyl)amino]purin-9-yl]-2-[[hydroxy-(2,2,2-trifluoroacetyl)oxyphosphoryl]oxymethyl]-4-(2,2,2-trifluoroacetyl)oxyoxolan-3-yl] 2,2,2-trifluoroacetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat