Sodium ((2S,3S,4R,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)-4-hydroxy-3-((2-((2-hydroxyethyl)amino)-3,4-dioxocyclobut-1-en-1-yl)amino)tetrahydrofuran-2-yl)methyl Phosphate

Analyte Name

Sodium ((2S,3S,4R,5R)-5-(2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)-4-hydroxy-3-((2-((2-hydroxyethyl)amino)-3,4-dioxocyclobut-1-en-1-yl)amino)tetrahydrofuran-2-yl)methyl Phosphate

Molecular Formula

C15 H17 N4 Na2 O11 P

Molecular Weight

506.269

Accurate Mass

506.043

SMILES

OCCNC1=C(N[C@H]2[C@@H](O)[C@@H](O[C@@H]2COP(=O)(O[Na])O[Na])N3C=CC(=O)NC3=O)C(=O)C1=O

InChI

InChI=1S/C15H19N4O11P.2Na/c20-4-2-16-9-10(12(23)11(9)22)18-8-6(5-29-31(26,27)28)30-14(13(8)24)19-3-1-7(21)17-15(19)25;;/h1,3,6,8,13-14,16,18,20,24H,2,4-5H2,(H,17,21,25)(H2,26,27,28);;/q;2*+1/p-2/t6-,8-,13-,14-;;/m1../s1

IUPAC

[[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-[[2-(2-hydroxyethylamino)-3,4-dioxocyclobuten-1-yl]amino]oxolan-2-yl]methoxy-sodiooxyphosphoryl]oxysodium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat