2-azanyl-9-[4-(hydroxymethyl)-7-oxidanyl-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-(hydroxymethyl)-7-oxidanyl-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[7-hydroxy-4-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one CAS Name: 2-amino-9-[7-hydroxy-4-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one IUPAC Name: 2-amino-9-[7-hydroxy-4-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one Traditional Name: 2-amino-9-(7-hydroxy-4-methylol-2,5-dioxabicyclo[2.2.1]heptan-6-yl)-3H-purin-6-one Formula: C11H13N5O5 MolecularWeight: 295.25142

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(C(C(O1)C(O2)N3C=NC4=C3NC(=NC4=O)N)O)CO

Isomeric SMILES

C1C2(C(C(O1)C(O2)N3C=NC4=C3NC(=NC4=O)N)O)CO

InChI

InChI=1S/C11H13N5O5/c12-10-14-7-4(8(19)15-10)13-3-16(7)9-5-6(18)11(1-17,21-9)2-20-5/h3,5-6,9,17-18H,1-2H2,(H3,12,14,15,19)