Analyte Name

6-Thioinosine 5'-Triphosphate

CAS Number

27652-34-2

Molecular Formula

C10 H15 N4 O13 P3 S

Molecular Weight

524.231

Accurate Mass

523.957

SMILES

O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(=O)(O)OP(=O)(O)OP(=O)(O)O)n2cnc3C(=S)NC=Nc23

InChI

InChI=1S/C10H15N4O13P3S/c15-6-4(1-24-29(20,21)27-30(22,23)26-28(17,18)19)25-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)31/h2-4,6-7,10,15-16H,1H2,(H,20,21)(H,22,23)(H,11,12,31)(H2,17,18,19)/t4-,6-,7-,10-/m1/s1

IUPAC

[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-sulfanylidene-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive Small Molecule

Product Format

Neat