2-azanyl-9-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-3H-purin-6-one Openeye Name: 2-amino-9-[[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]methyl]-3H-purin-6-one CAS Name: 2-amino-9-[[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]methyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)methyl]-3H-purin-6-one Formula: C11H15N5O5 MolecularWeight: 297.2673

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC3C(C(C(O3)CO)O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CC3C(C(C(O3)CO)O)O)NC(=NC2=O)N

InChI

InChI=1S/C11H15N5O5/c12-11-14-9-6(10(20)15-11)13-3-16(9)1-4-7(18)8(19)5(2-17)21-4/h3-5,7-8,17-19H,1-2H2,(H3,12,14,15,20)