Analyte Name

6-Methylthioinosine Triphosphate-13C2,15N

Molecular Formula

C9 ¹³C2 H17 N3 ¹⁵N O13 P3 S

Molecular Weight

541.24

Accurate Mass

540.98

SMILES

O[C@@H]1[C@H](O)[C@@H](COP(OP(OP(O)(O)=O)(O)=O)(O)=O)O[C@H]1N2C=[15N][13C]3=[13C]2N=CN=C3SC

InChI

InChI=1S/C11H17N4O13P3S/c1-32-10-6-9(12-3-13-10)15(4-14-6)11-8(17)7(16)5(26-11)2-25-30(21,22)28-31(23,24)27-29(18,19)20/h3-5,7-8,11,16-17H,2H2,1H3,(H,21,22)(H,23,24)(H2,18,19,20)/t5-,7-,8-,11-/m1/s1/i6+1,9+1,14+1

IUPAC

((2R,3S,4R,5R)-3,4-dihydroxy-5-(6-(methylthio)-9H-purin-9-yl-4,5-13C2-7-15N)tetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate

Unlabelled CAS Number

51373-46-7

SIL Type

Nitrogen, Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat