Analyte Name

Adenosine 5-Triphosphate Disodium Salt-13C5

Molecular Formula

13C5 C5 H14 N5 Na2 O13 P3

Molecular Weight

556.108

Accurate Mass

555.976

SMILES

Nc1ncnc2c1ncn2[13C@@H]3O[13C@H]([13CH2]OP(=O)(O)OP(=O)(O)OP(=O)(O[Na])O[Na])[13C@@H](O)[13C@H]3O

InChI

InChI=1S/C10H16N5O13P3.2Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20;;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20);;/q;2*+1/p-2/t4-,6-,7-,10-;;/m1../s1/i1+1,4+1,6+1,7+1,10+1;;

IUPAC

[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy(2,3,4,5-13C4)oxolan-2-yl](113C)methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-sodiooxyphosphoryl]oxysodium

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat