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| Standard English name | |
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| Cas No. | 103301-72-0 |
| Alias | sodium;[[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate |
| Canonical Smiles | [Na+].NC1NC(=O)C2N=CN([C@@H]3O[C@H](COP(O)(=O)OP([O-])(=O)OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H]3O)C=2N=1 |
| MDL No. | MFCD00070118 |
| Exact Mass | 627.05910 |
| Smiles | O=P(O)(OP([O-])(OC1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)=O)OC[C@@H](O2)[C@@H](O)[C@@H](O)[C@@H]2N3C(N=C(N)NC4=O)=C4N=C3.[Na+] |
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| Inchi | InChI=1S/C16H25N5O16P2.Na/c17-16-19-12-6(13(28)20-16)18-3-21(12)14-10(26)8(24)5(34-14)2-33-38(29,30)37-39(31,32)36-15-11(27)9(25)7(23)4(1-22)35-15;/h3-5,7-11,14-15,22-27H,1-2H2,(H,29,30)(H,31,32)(H3,17,19,20,28);/q;+1/p-1/t4-,5-,7-,8-,9+,10-,11-,14-,15?;/m1./s1 |
| InchiKey | YNBKOMFIRBMMFB-WAVFAVACSA-M |
| Remark |
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