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[(2R,3S,4R,5R)-5-(3-azanylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl [[(2R,3R,4R,5R)-5-imidazo[2,1-f]purin-3-yl-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphate
[(2R,3S,4R,5R)-5-(3-azanylpyridin-1-ium-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl [[(2R,3R,4R,5R)-5-imidazo[2,1-f]purin-3-yl-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphate
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Canonical SMILES:
C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN6C5=NC=C6)OP(=O)(O)O)O)O)O)N
Isomeric SMILES
C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN6C5=NC=C6)OP(=O)(O)O)O)O)O)N
InChI
InChI=1S/C22H28N7O16P3/c23-11-2-1-4-27(6-11)21-17(32)15(30)12(42-21)7-40-47(36,37)45-48(38,39)41-8-13-16(31)18(44-46(33,34)35)22(43-13)29-10-25-14-19-24-3-5-28(19)9-26-20(14)29/h1-6,9-10,12-13,15-18,21-22,30-32H,7-8,23H2,(H3-,33,34,35,36,37,38,39)/t12-,13-,15-,16-,17-,18-,21-,22-/m1/s1
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