Analyte Name

3'-Deoxy-N-[(4-methoxyphenyl)diphenylmethyl]-5'-O-[(4-methoxyphenyl)diphenylmethyl]adenosine-13C5

Molecular Formula

13C5 C45 H45 N5 O5

Molecular Weight

800.886

Accurate Mass

800.359

SMILES

COc1ccc(cc1)C(Nc2ncnc3c2ncn3[13C@@H]4O[13C@H]([13CH2]OC(c5ccccc5)(c6ccccc6)c7ccc(OC)cc7)[13CH2][13C@H]4O)(c8ccccc8)c9ccccc9

InChI

InChI=1S/C50H45N5O5/c1-57-41-27-23-37(24-28-41)49(35-15-7-3-8-16-35,36-17-9-4-10-18-36)54-46-45-47(52-33-51-46)55(34-53-45)48-44(56)31-43(60-48)32-59-50(38-19-11-5-12-20-38,39-21-13-6-14-22-39)40-25-29-42(58-2)30-26-40/h3-30,33-34,43-44,48,56H,31-32H2,1-2H3,(H,51,52,54)/t43-,44+,48+/m0/s1/i31+1,32+1,43+1,44+1,48+1

IUPAC

(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy](113C)methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl](2,3,4,5-13C4)oxolan-3-ol

Unlabelled CAS Number

101857-01-6

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat