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

Systemtic Name: 2-[6-azanyl-2-[5-(1-oxidanylcyclooctyl)pent-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-2-[5-(1-hydroxycyclooctyl)pent-1-ynyl]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-2-[5-(1-hydroxycyclooctyl)pent-1-ynyl]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-2-[5-(1-hydroxycyclooctyl)pent-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-2-[5-(1-hydroxycyclooctyl)pent-1-ynyl]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C23H33N5O5 MolecularWeight: 459.53862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)(CCCC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

Isomeric SMILES

C1CCCC(CCC1)(CCCC#CC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C23H33N5O5/c24-20-17-21(28(14-25-17)22-19(31)18(30)15(13-29)33-22)27-16(26-20)9-5-4-8-12-23(32)10-6-2-1-3-7-11-23/h14-15,18-19,22,29-32H,1-4,6-8,10-13H2,(H2,24,26,27)