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

Systemtic Name: 2-[6-azanyl-1-ethynyl-2-(1-oxidanylcyclohexyl)-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-1-ethynyl-2-(1-hydroxycyclohexyl)-2H-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-1-ethynyl-2-(1-hydroxycyclohexyl)-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-1-ethynyl-2-(1-hydroxycyclohexyl)-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-1-ethynyl-2-(1-hydroxycyclohexyl)-2H-purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

C#CN1C(N=C2C(=C1N)N=CN2C3C(C(C(O3)CO)O)O)C4(CCCCC4)O

Isomeric SMILES

C#CN1C(N=C2C(=C1N)N=CN2C3C(C(C(O3)CO)O)O)C4(CCCCC4)O

InChI

InChI=1S/C18H25N5O5/c1-2-22-14(19)11-15(21-17(22)18(27)6-4-3-5-7-18)23(9-20-11)16-13(26)12(25)10(8-24)28-16/h1,9-10,12-13,16-17,24-27H,3-8,19H2