O4-[[5-(2-azanyl-6-methoxy-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl] O1-methyl butanedioate

Systemtic Name: O4-[[5-(2-azanyl-6-methoxy-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl] O1-methyl butanedioate Openeye Name: O4-[[5-(2-amino-6-methoxy-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl] O1-methyl butanedioate CAS Name: butanedioic acid O4-[[5-(2-amino-6-methoxy-9-purinyl)-3,4-dihydroxy-2-oxolanyl]methyl] ester O1-methyl ester IUPAC Name: 4-O-[[5-(2-amino-6-methoxypurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl] 1-O-methyl butanedioate Traditional Name: succinic acid O4-[[5-(2-amino-6-methoxy-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl] ester O1-methyl ester Formula: C16H21N5O8 MolecularWeight: 411.36664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC2=C1N=CN2C3C(C(C(O3)COC(=O)CCC(=O)OC)O)O)N

Isomeric SMILES

COC1=NC(=NC2=C1N=CN2C3C(C(C(O3)COC(=O)CCC(=O)OC)O)O)N

InChI

InChI=1S/C16H21N5O8/c1-26-8(22)3-4-9(23)28-5-7-11(24)12(25)15(29-7)21-6-18-10-13(21)19-16(17)20-14(10)27-2/h6-7,11-12,15,24-25H,3-5H2,1-2H3,(H2,17,19,20)