2-[6-azanyl-8-(azepan-1-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-8-(azepan-1-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-8-(azepan-1-yl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-8-(1-azepanyl)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-8-(azepan-1-yl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-8-(azepan-1-yl)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C16H24N6O4 MolecularWeight: 364.39956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC3=C(N2C4C(C(C(O4)CO)O)O)N=CN=C3N

Isomeric SMILES

C1CCCN(CC1)C2=NC3=C(N2C4C(C(C(O4)CO)O)O)N=CN=C3N

InChI

InChI=1S/C16H24N6O4/c17-13-10-14(19-8-18-13)22(15-12(25)11(24)9(7-23)26-15)16(20-10)21-5-3-1-2-4-6-21/h8-9,11-12,15,23-25H,1-7H2,(H2,17,18,19)