2-(6-aminopurin-9-yl)-5-(aziridin-1-ium-1-ylmethyl)oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-(aziridin-1-ium-1-ylmethyl)oxolane-3,4-diol Openeye Name: 2-(6-aminopurin-9-yl)-5-(aziridin-1-ium-1-ylmethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(6-aminopurin-9-yl)-5-(1-aziridin-1-iumylmethyl)oxolane-3,4-diol IUPAC Name: 2-(6-aminopurin-9-yl)-5-(aziridin-1-ium-1-ylmethyl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-(ethylenimin-1-ium-1-ylmethyl)tetrahydrofuran-3,4-diol Formula: C12H17N6O3+ MolecularWeight: 293.30178

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]1CC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O

Isomeric SMILES

C1C[NH+]1CC2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O

InChI

InChI=1S/C12H16N6O3/c13-10-7-11(15-4-14-10)18(5-16-7)12-9(20)8(19)6(21-12)3-17-1-2-17/h4-6,8-9,12,19-20H,1-3H2,(H2,13,14,15)/p+1