(2S,3R,4R)-5-(6-aminopurin-9-yl)-N-cyclopropyl-3,4-bis(dioxidanyl)oxolane-2-carboxamide

Systemtic Name: (2S,3R,4R)-5-(6-aminopurin-9-yl)-N-cyclopropyl-3,4-bis(dioxidanyl)oxolane-2-carboxamide Openeye Name: (2S,3R,4R)-5-(6-aminopurin-9-yl)-N-cyclopropyl-3,4-dihydroperoxy-tetrahydrofuran-2-carboxamide CAS Name: (2S,3R,4R)-5-(6-aminopurin-9-yl)-N-cyclopropyl-3,4-dihydroperoxy-2-oxolanecarboxamide IUPAC Name: (2S,3R,4R)-5-(6-aminopurin-9-yl)-N-cyclopropyl-3,4-dihydroperoxyoxolane-2-carboxamide Traditional Name: (2S,3R,4R)-5-adenin-9-yl-N-cyclopropyl-3,4-dihydroperoxy-tetrahydrofuran-2-carboxamide Formula: C13H16N6O6 MolecularWeight: 352.30274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)OO)OO

Isomeric SMILES

C1CC1NC(=O)[C@@H]2[C@H]([C@H](C(O2)N3C=NC4=C3N=CN=C4N)OO)OO

InChI

InChI=1S/C13H16N6O6/c14-10-6-11(16-3-15-10)19(4-17-6)13-9(25-22)7(24-21)8(23-13)12(20)18-5-1-2-5/h3-5,7-9,13,21-22H,1-2H2,(H,18,20)(H2,14,15,16)/t7-,8+,9-,13?/m1/s1