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| Standard English name | |
|---|---|
| Cas No. | 101985-79-9 |
| Alias | (2R,3S,5R)-2-((((((2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl)oxy)(hydroxy)phosphoryl)oxy)methyl)-5-(6-amino-9H-purin-9-yl)tetrahydrofuran-3-yl (((2R,3S,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl)methyl) hydrogen phosphate |
| Canonical Smiles | NC1NC2=C(N=CN2C2CC(O)C(COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3CO)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)O2)C(=O)N=1 |
| MDL No. | |
| Exact Mass | 869.20073 |
| Smiles | O=C1N=C(N)NC2=C1N=CN2C3OC(COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5CO)N6C=CC(=NC6=O)N)N7C=NC=8C(=NC=NC87)N)C(O)C3 |
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| Inchi | InChI=1S/C29H37N13O15P2/c30-18-1-2-40(29(46)37-18)20-4-13(15(6-43)53-20)56-59(49,50)52-8-17-14(5-21(55-17)41-10-35-22-24(31)33-9-34-25(22)41)57-58(47,48)51-7-16-12(44)3-19(54-16)42-11-36-23-26(42)38-28(32)39-27(23)45/h1-2,9-17,19-21,43-44H,3-8H2,(H,47,48)(H,49,50)(H2,30,37,46)(H2,31,33,34)(H3,32,38,39,45) |
| InchiKey | KVJPGPUZJKYAFG-UHFFFAOYSA-N |
| Remark |
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