Analyte Name

2',3'-O-(1-Methylethylidene)-6-thio-5'-inosinic Acid Bis(1,1-Dimethylethyl) Ester

CAS Number

1375103-71-1

Molecular Formula

C21H33N4O7PS

Molecular Weight

516.55

Accurate Mass

516.1808

SMILES

CC(C)(C)OP(=O)(OC[C@H]1O[C@@H](C2OC(C)(C)OC12)n3cnc4C(=S)N=CNc34)OC(C)(C)C

InChI

InChI=1S/C21H33N4O7PS/c1-19(2,3)31-33(26,32-20(4,5)6)27-9-12-14-15(30-21(7,8)29-14)18(28-12)25-11-24-13-16(25)22-10-23-17(13)34/h10-12,14-15,18H,9H2,1-8H3,(H,22,23,34)/t12-,14?,15?,18+/m1/s1

IUPAC

ditert-butyl [(4S,6R)-2,2-dimethyl-4-(6-sulfanylidene-3H-purin-9-yl)-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]methyl phosphate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat