2',5'-Oligoadenyl-5'-Diphosphate
[CAS# 84824-01-1]

Identification

• Name: 2',5'-Oligoadenyl-5'-Diphosphate
• Synonyms: [1-[[(2R,3S,4R,5R)-5-(6-Amino-8-Bromo-Purin-9-Yl)-4-Hydroxy-3-(Hydroxy-Phosphonooxy-Phosphoryl)Oxy-Tetrahydrofuran-2-Yl]Methyl]-1-[(2S,3S,4R,5R)-5-(6-Amino-8,8-Dibromo-7H-Purin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]-2-[(2R,3R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-2,3-Dihydrofuran-2-Yl]Ethyl] Phosphono Hydrogen Phosphate; [1-[[(2R,3S,4R,5R)-5-(6-Amino-8-Bromo-9-Purinyl)-4-Hydroxy-3-(Hydroxy-Phosphonooxyphosphoryl)Oxy-2-Tetrahydrofuranyl]Methyl]-1-[(2S,3S,4R,5R)-5-(6-Amino-8,8-Dibromo-7H-Purin-9-Yl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]-2-[(2R,3R)-5-(6-Amino-9-Purinyl)-3,4-Dihydroxy-2,3-Dihydrofuran-2-Yl]Ethyl] Phosphono Hydrogen Phosphate; [1-[(2R,3S,4R,5R)-5-(6-Amino-8-Bromo-Purin-9-Yl)-4-Hydroxy-3-(Hydroxy-Phosphonooxy-Phosphoryl)Oxy-Oxolan-2-Yl]-2-[(2S,3S,4R,5R)-5-(6-Amino-8,8-Dibromo-7H-Purin-9-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]-3-[(2R,3R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-2,3-Dihydrofuran-2-Yl]Propan-2-Yl] Phosphono Hydrogen Phosphate
• Molecular Formula: C₃₀H₃₆Br₃N₁₅O₂₂P₄
• Molecular Weight: 1322.31
• CAS Registry Number: 84824-01-1
• SMILES: [C@@H]3(O[C@@H](N1C(Br)(Br)NC2=C(N=CN=C12)N)[C@H](O)[C@@H]3O)C(O[P](O[P](=O)(O)O)(=O)O)(C[C@H]6O[C@@H]([N]4C5=C(N=C4Br)C(=NC=N5)N)[C@H](O)[C@@H]6O[P](O[P](=O)(O)O)(=O)O)C[C@H]7OC(=C(O)[C@@H]7O)[N]8C9=C(N=C8)C(=NC=N9)N
• InChI: 1S/C30H36Br3N15O22P4/c31-28-44-10-20(35)38-4-41-23(10)47(28)26-16(53)17(67-73(60,61)69-71(54,55)56)8(65-26)2-29(68-74(62,63)70-72(57,58)59,1-7-12(49)14(51)25(64-7)46-6-43-9-19(34)37-3-40-22(9)46)18-13(50)15(52)27(66-18)48-24-11(45-30(48,32)33)21(36)39-5-42-24/h3-8,12-13,15-18,26-27,45,49-53H,1-2H2,(H,60,61)(H,62,63)(H2,34,37,40)(H2,35,38,41)(H2,36,39,42)(H2,54,55,56)(H2,57,58,59)/t7-,8-,12-,13+,15-,16-,17-,18+,26-,27-,29?/m1/s1
• InChIKey: MLVFFFFBBPSDMP-IYSFOZBBSA-N

Properties

• Density: 2.905g/cm³ (Cal.)