5-(6-aminopurin-9-yl)-4-(5-azanylpentoxy)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-4-(5-azanylpentoxy)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]oxolan-3-ol Openeye Name: 4-(5-aminopentoxy)-5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]tetrahydrofuran-3-ol CAS Name: 4-(5-aminopentoxy)-5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-oxolanol IUPAC Name: 4-(5-aminopentoxy)-5-(6-aminopurin-9-yl)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-ol Traditional Name: 5-adenin-9-yl-4-(5-aminopentoxy)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]tetrahydrofuran-3-ol Formula: C36H42N6O6 MolecularWeight: 654.75528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)OCCCCCN)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)OCCCCCN)O

InChI

InChI=1S/C36H42N6O6/c1-44-27-15-11-25(12-16-27)36(24-9-5-3-6-10-24,26-13-17-28(45-2)18-14-26)47-21-29-31(43)32(46-20-8-4-7-19-37)35(48-29)42-23-41-30-33(38)39-22-40-34(30)42/h3,5-6,9-18,22-23,29,31-32,35,43H,4,7-8,19-21,37H2,1-2H3,(H2,38,39,40)