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

Systemtic Name: (3aR,4R,6S,6aS)-4-(6-aminopurin-9-yl)-N-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Openeye Name: (3aR,4R,6S,6aS)-4-(6-aminopurin-9-yl)-N-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide CAS Name: (3aR,4R,6S,6aS)-4-(6-aminopurin-9-yl)-N-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide IUPAC Name: (3aR,4R,6S,6aS)-4-(6-aminopurin-9-yl)-N-[(3,4-dimethoxyphenyl)methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Traditional Name: (3aR,4R,6S,6aS)-4-adenin-9-yl-2,2-dimethyl-N-veratryl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxamide Formula: C22H26N6O6 MolecularWeight: 470.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(O1)C(OC2C(=O)NCC3=CC(=C(C=C3)OC)OC)N4C=NC5=C4N=CN=C5N)C

Isomeric SMILES

CC1(O[C@H]2[C@@H](O1)[C@@H](O[C@@H]2C(=O)NCC3=CC(=C(C=C3)OC)OC)N4C=NC5=C4N=CN=C5N)C

InChI

InChI=1S/C22H26N6O6/c1-22(2)33-15-16(20(29)24-8-11-5-6-12(30-3)13(7-11)31-4)32-21(17(15)34-22)28-10-27-14-18(23)25-9-26-19(14)28/h5-7,9-10,15-17,21H,8H2,1-4H3,(H,24,29)(H2,23,25,26)/t15-,16+,17-,21-/m1/s1