[1-[5-[2,6-bis(azanyl)purin-9-yl]-3-oxidanyl-oxolan-2-yl]-3-methyl-2-oxidanylidene-butyl] 2-methylpropanoate

Systemtic Name: [1-[5-[2,6-bis(azanyl)purin-9-yl]-3-oxidanyl-oxolan-2-yl]-3-methyl-2-oxidanylidene-butyl] 2-methylpropanoate Openeye Name: [1-[5-(2,6-diaminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-3-methyl-2-oxo-butyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [1-[5-(2,6-diamino-9-purinyl)-3-hydroxy-2-oxolanyl]-3-methyl-2-oxobutyl] ester IUPAC Name: [1-[5-(2,6-diaminopurin-9-yl)-3-hydroxyoxolan-2-yl]-3-methyl-2-oxobutyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [1-[5-(2,6-diaminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]-2-keto-3-methyl-butyl] ester Formula: C18H26N6O5 MolecularWeight: 406.43624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C1C(CC(O1)N2C=NC3=C2N=C(N=C3N)N)O)OC(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)C(C1C(CC(O1)N2C=NC3=C2N=C(N=C3N)N)O)OC(=O)C(C)C

InChI

InChI=1S/C18H26N6O5/c1-7(2)12(26)14(29-17(27)8(3)4)13-9(25)5-10(28-13)24-6-21-11-15(19)22-18(20)23-16(11)24/h6-10,13-14,25H,5H2,1-4H3,(H4,19,20,22,23)