6-(3,3-DIMETHYLALLYLAMINO)-9-BETA-D-RIBOFURANOSYLPURINE-5'-MONOPHOSPHATE DISODIUM MONOHYDRATE

CAS No.
20268-93-3
CCD No.
CCD04458010
Formula
C15 H20 N5 O7 P . 2 Na . H2 O
MolWeight
477.32

Basic Information

Product Name: 6-(3,3-DIMETHYLALLYLAMINO)-9-BETA-D-RIBOFURANOSYLPURINE-5'-MONOPHOSPHATE DISODIUM MONOHYDRATE
CAS: 20268-93-3
English Synonyms: 6-(3,3-DIMETHYLALLYLAMINO)-9-BETA-D-RIBOFURANOSYLPURINE-5'-MONOPHOSPHATE DISODIUM MONOHYDRATE
MDL Number.: MFCD18781886
H bond acceptor: 12
H bond donor: 3
Smile: CC(=CCNc1c2c(ncn1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])[O-])O)O)C.O.[Na+].[Na+]
InChi: InChI=1S/C15H22N5O7P.2Na.H2O/c1-8(2)3-4-16-13-10-14(18-6-17-13)20(7-19-10)15-12(22)11(21)9(27-15)5-26-28(23,24)25;;;/h3,6-7,9,11-12,15,21-22H,4-5H2,1-2H3,(H,16,17,18)(H2,23,24,25);;;1H2/q;2*+1;/p-2/t9-,11-,12-,15-;;;/m1.../s1
InChiKey: InChIKey=KMDOJABUPASCSN-QHWSBDPXSA-L

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