(3aR,4R,6S,6aS)-N-(1-adamantyl)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide

Systemtic Name: (3aR,4R,6S,6aS)-N-(1-adamantyl)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Openeye Name: (3aR,4R,6S,6aS)-N-(1-adamantyl)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide CAS Name: (3aR,4R,6S,6aS)-N-(1-adamantyl)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide IUPAC Name: (3aR,4R,6S,6aS)-N-(1-adamantyl)-4-(6-aminopurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Traditional Name: (3aR,4R,6S,6aS)-N-(1-adamantyl)-4-adenin-9-yl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Formula: C23H30N6O4 MolecularWeight: 454.5221

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(O1)C(OC2C(=O)NC34CC5CC(C3)CC(C5)C4)N6C=NC7=C6N=CN=C7N)C

Isomeric SMILES

CC1(O[C@H]2[C@@H](O1)[C@@H](O[C@@H]2C(=O)NC34CC5CC(C3)CC(C5)C4)N6C=NC7=C6N=CN=C7N)C

InChI

InChI=1S/C23H30N6O4/c1-22(2)32-15-16(20(30)28-23-6-11-3-12(7-23)5-13(4-11)8-23)31-21(17(15)33-22)29-10-27-14-18(24)25-9-26-19(14)29/h9-13,15-17,21H,3-8H2,1-2H3,(H,28,30)(H2,24,25,26)/t11?,12?,13?,15-,16+,17-,21-,23?/m1/s1