[(2R,3S,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl cyclohexanecarboxylate

Systemtic Name: [(2R,3S,5R)-5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl cyclohexanecarboxylate Openeye Name: [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [(2R,3S,5R)-5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C17H23N5O5 MolecularWeight: 377.39502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCC2C(CC(O2)N3C=NC4=C3NC(=NC4=O)N)O

Isomeric SMILES

C1CCC(CC1)C(=O)OC[C@@H]2[C@H](C[C@@H](O2)N3C=NC4=C3NC(=NC4=O)N)O

InChI

InChI=1S/C17H23N5O5/c18-17-20-14-13(15(24)21-17)19-8-22(14)12-6-10(23)11(27-12)7-26-16(25)9-4-2-1-3-5-9/h8-12,23H,1-7H2,(H3,18,20,21,24)/t10-,11+,12+/m0/s1