2-(hydroxymethyl)-5-[6-(pyridin-2-ylmethylamino)purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-(pyridin-2-ylmethylamino)purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-(2-pyridylmethylamino)purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-(2-pyridinylmethylamino)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-(pyridin-2-ylmethylamino)purin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[6-(2-pyridylmethylamino)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C16H18N6O4 MolecularWeight: 358.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=NC(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C16H18N6O4/c23-6-10-12(24)13(25)16(26-10)22-8-21-11-14(19-7-20-15(11)22)18-5-9-3-1-2-4-17-9/h1-4,7-8,10,12-13,16,23-25H,5-6H2,(H,18,19,20)