[(2R,3S,5R)-5-(6-benzamidopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl [1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethyl] carbonate

Systemtic Name: [(2R,3S,5R)-5-(6-benzamidopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl [1-(3,5-dimethoxyphenyl)-2-oxidanylidene-2-phenyl-ethyl] carbonate Openeye Name: [(2R,3S,5R)-5-(6-benzamidopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [1-(3,5-dimethoxyphenyl)-2-oxo-2-phenyl-ethyl] carbonate CAS Name: carbonic acid [(2R,3S,5R)-5-(6-benzamido-9-purinyl)-3-hydroxy-2-oxolanyl]methyl [1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl] ester IUPAC Name: [(2R,3S,5R)-5-(6-benzamidopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl [1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl] carbonate Traditional Name: carbonic acid [(2R,3S,5R)-5-(6-benzamidopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl [1-(3,5-dimethoxyphenyl)-2-keto-2-phenyl-ethyl] ester Formula: C34H31N5O9 MolecularWeight: 653.63804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(C(=O)C2=CC=CC=C2)OC(=O)OCC3C(CC(O3)N4C=NC5=C4N=CN=C5NC(=O)C6=CC=CC=C6)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(C(=O)C2=CC=CC=C2)OC(=O)OC[C@@H]3[C@H](C[C@@H](O3)N4C=NC5=C4N=CN=C5NC(=O)C6=CC=CC=C6)O)OC

InChI

InChI=1S/C34H31N5O9/c1-44-23-13-22(14-24(15-23)45-2)30(29(41)20-9-5-3-6-10-20)48-34(43)46-17-26-25(40)16-27(47-26)39-19-37-28-31(35-18-36-32(28)39)38-33(42)21-11-7-4-8-12-21/h3-15,18-19,25-27,30,40H,16-17H2,1-2H3,(H,35,36,38,42)/t25-,26+,27+,30?/m0/s1