[5-[2-(2-methylpropylamino)-6-oxidanylidene-3H-purin-9-yl]-4-oxidanyl-3-(4-oxidanylidenepentanoyloxy)oxolan-2-yl]methyl 4-oxidanylidenepentanoate

Systemtic Name: [5-[2-(2-methylpropylamino)-6-oxidanylidene-3H-purin-9-yl]-4-oxidanyl-3-(4-oxidanylidenepentanoyloxy)oxolan-2-yl]methyl 4-oxidanylidenepentanoate Openeye Name: [4-hydroxy-5-[2-(isobutylamino)-6-oxo-3H-purin-9-yl]-3-(4-oxopentanoyloxy)tetrahydrofuran-2-yl]methyl 4-oxopentanoate CAS Name: 4-oxopentanoic acid [3-(1,4-dioxopentoxy)-4-hydroxy-5-[2-(2-methylpropylamino)-6-oxo-3H-purin-9-yl]-2-oxolanyl]methyl ester IUPAC Name: [4-hydroxy-5-[2-(2-methylpropylamino)-6-oxo-3H-purin-9-yl]-3-(4-oxopentanoyloxy)oxolan-2-yl]methyl 4-oxopentanoate Traditional Name: 4-ketovaleric acid [4-hydroxy-5-[2-(isobutylamino)-6-keto-3H-purin-9-yl]-3-(4-ketopentanoyloxy)tetrahydrofuran-2-yl]methyl ester Formula: C24H33N5O9 MolecularWeight: 535.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COC(=O)CCC(=O)C)OC(=O)CCC(=O)C)O

Isomeric SMILES

CC(C)CNC1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COC(=O)CCC(=O)C)OC(=O)CCC(=O)C)O

InChI

InChI=1S/C24H33N5O9/c1-12(2)9-25-24-27-21-18(22(35)28-24)26-11-29(21)23-19(34)20(38-17(33)8-6-14(4)31)15(37-23)10-36-16(32)7-5-13(3)30/h11-12,15,19-20,23,34H,5-10H2,1-4H3,(H2,25,27,28,35)