| Pack Size | Availability | Purity | Price |
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| Standard English name | |
|---|---|
| Cas No. | 2638447-87-5 |
| Alias | 9-((2R,3R,4S,5R)-5-((((((((((2R,3R,4R,5R)-3-(((((2R,3S,4R,5R)-3,4-dihydroxy-5-(2-imino-6-oxo-1,2,5,6-tetrahydro-9H-purin-9-yl)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)-5-(2,4-dioxotetrahydropyrimidin-1(2H)-yl)-4-methoxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)oxidophosphoryl)oxy)methyl)-3,4-dihydroxytetrahydrofuran-2-yl)-2-imino-7-methyl-6-oxo-2,5,6,9-tetrahydro-1H-purin-7-ium |
| Canonical Smiles | CO[C@H]1[C@@H](O[C@H](COP(O)(=O)OP(O)(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=[N+](C)C3C2=NC(=N)NC3=O)[C@H]1OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2C1=NC(=N)NC2=O)N1CCC(=O)NC1=O |
| MDL No. | |
| Exact Mass | 1,124.14402 |
| Smiles | C[N+]1=CN([C@H]2[C@H](O)[C@H](O)[C@@H](COP([O-])(OP(O)(OP(O)(OC[C@@H]3[C@@H](OP(O)(OC[C@@H]4[C@@H](O)[C@@H](O)[C@H](N5C=NC6C5=NC(NC6=O)=N)O4)=O)[C@@H](OC)[C@H](N7CCC(NC7=O)=O)O3)=O)=O)=O)O2)C8=NC(NC(C81)=O)=N |
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| Inchi | InChI=1S/C31H44N12O26P4/c1-40-9-43(23-15(40)25(50)39-30(33)37-23)27-19(48)17(46)11(65-27)6-62-71(54,55)68-73(58,59)69-72(56,57)63-7-12-20(21(60-2)28(66-12)41-4-3-13(44)35-31(41)51)67-70(52,53)61-5-10-16(45)18(47)26(64-10)42-8-34-14-22(42)36-29(32)38-24(14)49/h8-12,14-21,26-28,45-48H,3-7H2,1-2H3,(H8-,32,33,35,38,39,44,49,50,51,52,53,54,55,56,57,58,59)/t10-,11-,12-,14?,15?,16-,17-,18-,19-,20-,21-,26-,27-,28-/m1/s1 |
| InchiKey | BQKCDKPZKKHQLA-YFZWYXJHSA-N |
| Remark |
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