[(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[6-(methylamino)purin-9-yl]oxolan-3-yl] bis(phenylmethyl) phosphate

Systemtic Name: [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[6-(methylamino)purin-9-yl]oxolan-3-yl] bis(phenylmethyl) phosphate Openeye Name: dibenzyl [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[6-(methylamino)purin-9-yl]tetrahydrofuran-3-yl] phosphate CAS Name: phosphoric acid [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-[6-(methylamino)-9-purinyl]-3-oxolanyl] bis(phenylmethyl) ester IUPAC Name: dibenzyl [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-[6-(methylamino)purin-9-yl]oxolan-3-yl] phosphate Traditional Name: phosphoric acid dibenzyl [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[6-(methylamino)purin-9-yl]tetrahydrofuran-3-yl] ester Formula: C46H46N5O8P MolecularWeight: 827.859901

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2C3CC(C(O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(=O)(OCC7=CC=CC=C7)OCC8=CC=CC=C8

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2[C@H]3C[C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(=O)(OCC7=CC=CC=C7)OCC8=CC=CC=C8

InChI

InChI=1S/C46H46N5O8P/c1-47-44-43-45(49-31-48-44)51(32-50-43)42-27-40(59-60(52,56-28-33-13-7-4-8-14-33)57-29-34-15-9-5-10-16-34)41(58-42)30-55-46(35-17-11-6-12-18-35,36-19-23-38(53-2)24-20-36)37-21-25-39(54-3)26-22-37/h4-26,31-32,40-42H,27-30H2,1-3H3,(H,47,48,49)/t40-,41+,42+/m0/s1