
| CAS Number | 929904-85-8 |
| Catalog Number | AG00GWOY |
| Chemical Name | S-110 |
| IUPAC Name | sodium;[(2R,3S,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl [(2R,3S,5R)-5-(4-amino-2-oxo-1,3,5-triazin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] phosphate |
| InChI | InChI=1S/C18H24N9O10P.Na/c19-16-22-6-27(18(31)25-16)12-2-8(9(3-28)35-12)37-38(32,33)34-4-10-7(29)1-11(36-10)26-5-21-13-14(26)23-17(20)24-15(13)30;/h5-12,28-29H,1-4H2,(H,32,33)(H2,19,25,31)(H3,20,23,24,30);/q;+1/p-1/t7-,8-,9+,10+,11+,12+;/m0./s1 |
| InChI Key | XLHBNJPXFOZFNJ-BYKQGDNKSA-M |
| MDL Number | MFCD28138338 |
| Molecular Formula | C18H23N9NaO10P |
| Molecular Weight | 579.3931 |
| SMILES | N1C(=O)C2N=CN([C@@H]3O[C@H](COP(O[Na])(=O)O[C@H]4C[C@H](N5C(=O)N=C(N)N=C5)O[C@@H]4CO)[C@@H](O)C3)C=2NC=1N |
| UNII | 0RB89YH367 |
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