[(1R,4R,6R,7S)-6-(6-aminopurin-9-yl)-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl methanesulfonate

Systemtic Name: [(1R,4R,6R,7S)-6-(6-aminopurin-9-yl)-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl methanesulfonate Openeye Name: [(1R,4R,6R,7S)-6-(6-aminopurin-9-yl)-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(1R,4R,6R,7S)-6-(6-aminopurin-9-yl)-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl ester IUPAC Name: [(1R,4R,6R,7S)-6-(6-aminopurin-9-yl)-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(1R,4R,6R,7S)-6-adenin-9-yl-7-azido-2,5-dioxabicyclo[2.2.1]heptan-4-yl]methyl ester Formula: C12H14N8O5S MolecularWeight: 382.35516

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC12COC(C1N=[N+]=[N-])C(O2)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

CS(=O)(=O)OC[C@]12CO[C@H]([C@@H]1N=[N+]=[N-])[C@@H](O2)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C12H14N8O5S/c1-26(21,22)24-3-12-2-23-7(8(12)18-19-14)11(25-12)20-5-17-6-9(13)15-4-16-10(6)20/h4-5,7-8,11H,2-3H2,1H3,(H2,13,15,16)/t7-,8+,11-,12-/m1/s1