basic_info |
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Product_Name: | THYMIDINE-5'-DIPHOSPHATE BARIUM SALT |
EnglishSynonyms: | THYMIDINE-5'-DIPHOSPHATE BARIUM SALT ; BARIUM ((2R,3S,5R)-3-HYDROXY-5-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)TETRAHYDROFURAN-2-YL)METHYL DIPHOSPHATE |
pro_mdlNumber: | MFCD11615689 |
pro_acceptors: | 13 |
pro_donors: | 2 |
pro_smile: | Cc1cn(c(=O)[nH]c1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])[O-])O.Cc1cn(c(=O)[nH]c1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])[O-])O.[Ba+2].[Ba+2].[Ba+2] |
InChi: | InChI=1S/2C10H16N2O11P2.3Ba/c2*1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(22-8)4-21-25(19,20)23-24(16,17)18;;;/h2*3,6-8,13H,2,4H2,1H3,(H,19,20)(H,11,14,15)(H2,16,17,18);;;/q;;3*+2/p-6/t2*6-,7+,8+;;;/m00.../s1 |
InChiKey: | InChIKey=JWVRLSQCKYCFOF-MBTJDTMGSA-H |
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