2-[6-azanyl-2-[2-(1-oxidanylcyclopropyl)ethynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-2-[2-(1-oxidanylcyclopropyl)ethynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[2-(1-hydroxycyclopropyl)ethynyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[2-(1-hydroxycyclopropyl)ethynyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[2-(1-hydroxycyclopropyl)ethynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[2-(1-hydroxycyclopropyl)ethynyl]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C15H17N5O5 MolecularWeight: 347.32598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

Isomeric SMILES

C1CC1(C#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C15H17N5O5/c16-12-9-13(19-8(18-12)1-2-15(24)3-4-15)20(6-17-9)14-11(23)10(22)7(5-21)25-14/h6-7,10-11,14,21-24H,3-5H2,(H2,16,18,19)