[(2R,3S,4R,5R)-5-(2-Amino-7-Methyl-6-Oxo-3,8-Dihydropurin-9-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methyl Phosphono Hydrogen Phosphate
[CAS# 104809-16-7]

Identification

• Name: [(2R,3S,4R,5R)-5-(2-Amino-7-Methyl-6-Oxo-3,8-Dihydropurin-9-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methyl Phosphono Hydrogen Phosphate
• Synonyms: [(2R,3S,4R,5R)-5-(2-Amino-7-Methyl-6-Oxo-3,8-Dihydropurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(2-Amino-7-Methyl-6-Oxo-3,8-Dihydropurin-9-Yl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(2-Amino-6-Keto-7-Methyl-3,8-Dihydropurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
• Molecular Formula: C₁₁H₁₉N₅O₁₁P₂
• Molecular Weight: 459.25
• CAS Registry Number: 104809-16-7
• SMILES: [P](OC[C@H]3O[C@@H](N1CN(C2=C1NC(=NC2=O)N)C)[C@H](O)[C@@H]3O)(O[P](O)(O)=O)(O)=O
• InChI: 1S/C11H19N5O11P2/c1-15-3-16(8-5(15)9(19)14-11(12)13-8)10-7(18)6(17)4(26-10)2-25-29(23,24)27-28(20,21)22/h4,6-7,10,17-18H,2-3H2,1H3,(H,23,24)(H2,20,21,22)(H3,12,13,14,19)/t4-,6-,7-,10-/m1/s1
• InChIKey: QQODJOAVWUWVHJ-KQYNXXCUSA-N