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| Standard English name | |
|---|---|
| Cas No. | 2791-46-0 |
| Alias | ((2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl ((1R)-((2S,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)((((2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)methyl) hydrogen phosphate |
| Canonical Smiles | NC1C=CN([C@@H]2O[C@H](COP(O)(=O)O[C@@H]([C@H]3O[C@H]([C@H](O)[C@@H]3O)N3C=CC(=O)NC3=O)P(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)N3C=CC(=O)NC3=O)[C@@H](O)[C@H]2O)C(=O)N=1 |
| MDL No. | |
| Exact Mass | 855.13613 |
| Smiles | O[C@@H]([C@H]([C@H](N1C(N=C(C=C1)N)=O)O2)O)[C@H]2COP(O[C@H](P(OC[C@@H]3[C@H]([C@H]([C@H](N4C(NC(C=C4)=O)=O)O3)O)O)(O)=O)[C@@H]5[C@H]([C@H]([C@H](N6C(NC(C=C6)=O)=O)O5)O)O)(O)=O |
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| Inchi | InChI=1S/C27H35N7O21P2/c28-11-1-4-32(25(43)29-11)21-18(41)15(38)10(53-21)8-51-57(48,49)55-24(20-16(39)19(42)23(54-20)34-6-3-13(36)31-27(34)45)56(46,47)50-7-9-14(37)17(40)22(52-9)33-5-2-12(35)30-26(33)44/h1-6,9-10,14-24,37-42H,7-8H2,(H,46,47)(H,48,49)(H2,28,29,43)(H,30,35,44)(H,31,36,45)/t9-,10-,14-,15-,16+,17-,18-,19-,20+,21-,22-,23-,24-/m1/s1 |
| InchiKey | BLKQJLGRVMQPBS-IHKHBJSRSA-N |
| Remark |
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