2-(hexylamino)-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-(hexylamino)-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-(hexylamino)-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-(hexylamino)-9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-(hexylamino)-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-(hexylamino)-9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-3H-purin-6-one Formula: C16H25N5O4 MolecularWeight: 351.4008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C(O3)CO)O

Isomeric SMILES

CCCCCCNC1=NC(=O)C2=C(N1)N(C=N2)C3CC(C(O3)CO)O

InChI

InChI=1S/C16H25N5O4/c1-2-3-4-5-6-17-16-19-14-13(15(24)20-16)18-9-21(14)12-7-10(23)11(8-22)25-12/h9-12,22-23H,2-8H2,1H3,(H2,17,19,20,24)