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

Systemtic Name: 2-[6-azanyl-2-[4-(1-oxidanylcyclopropyl)but-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[4-(1-hydroxycyclopropyl)but-1-ynyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[4-(1-hydroxycyclopropyl)but-1-ynyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[4-(1-hydroxycyclopropyl)but-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[4-(1-hydroxycyclopropyl)but-1-ynyl]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H21N5O5 MolecularWeight: 375.37914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O5/c18-14-11-15(21-10(20-14)3-1-2-4-17(26)5-6-17)22(8-19-11)16-13(25)12(24)9(7-23)27-16/h8-9,12-13,16,23-26H,2,4-7H2,(H2,18,20,21)