9-[(3R,4S)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-7-methyl-3H-purin-9-ium-6-one

Systemtic Name: 9-[(3R,4S)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-7-methyl-3H-purin-9-ium-6-one Openeye Name: 9-[(3R,4S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-3H-purin-9-ium-6-one CAS Name: 9-[(3R,4S)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-7-methyl-3H-purin-9-ium-6-one IUPAC Name: 9-[(3R,4S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3H-purin-9-ium-6-one Traditional Name: 9-[(3R,4S)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-7-methyl-3H-purin-9-ium-6-one Formula: C11H15N4O5+ MolecularWeight: 283.2606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C2=C1C(=O)N=CN2)C3C(C(C(O3)CO)O)O

Isomeric SMILES

CN1C=[N+](C2=C1C(=O)N=CN2)C3[C@@H]([C@@H](C(O3)CO)O)O

InChI

InChI=1S/C11H14N4O5/c1-14-4-15(9-6(14)10(19)13-3-12-9)11-8(18)7(17)5(2-16)20-11/h3-5,7-8,11,16-18H,2H2,1H3/p+1/t5?,7-,8-,11?/m1/s1