5-(hydroxymethyl)-2-[6-(methylamino)purin-9-yl]oxane-3,4-diol

Systemtic Name: 5-(hydroxymethyl)-2-[6-(methylamino)purin-9-yl]oxane-3,4-diol Openeye Name: 5-(hydroxymethyl)-2-[6-(methylamino)purin-9-yl]tetrahydropyran-3,4-diol CAS Name: 5-(hydroxymethyl)-2-[6-(methylamino)-9-purinyl]oxane-3,4-diol IUPAC Name: 5-(hydroxymethyl)-2-[6-(methylamino)purin-9-yl]oxane-3,4-diol Traditional Name: 2-[6-(methylamino)purin-9-yl]-5-methylol-tetrahydropyran-3,4-diol Formula: C12H17N5O4 MolecularWeight: 295.29448

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2C3C(C(C(CO3)CO)O)O

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2C3C(C(C(CO3)CO)O)O

InChI

InChI=1S/C12H17N5O4/c1-13-10-7-11(15-4-14-10)17(5-16-7)12-9(20)8(19)6(2-18)3-21-12/h4-6,8-9,12,18-20H,2-3H2,1H3,(H,13,14,15)