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8‐Aza‐7‐deaza‐7‐propynyladenosine methanol solvate
Authors:Wenqing Lin  Kuiying Xu  Henning Eickmeier  Frank Seela
Abstract:In the title compound, 4‐amino‐3‐propynyl‐1‐(β‐d ‐ribofur­anosyl)‐1H‐pyrazolo3,4‐d]pyrimidine methanol solvate, C13H15N5O4·CH3OH, the torsion angle of the N‐glycosylic bond is between anti and high‐anti χ = −101.8 (5)°]. The ribofuranose moiety adopts the C3′‐endo (3T2) sugar conformation (N‐type) and the conformation at the exocyclic C—C bond is +sc (gauche, gauche). The propynyl group is out of the plane of the nucleobase and is bent. The compound forms a three‐dimensional network which is stabilized by several hydrogen bonds (O—H·O and O—H·N). The nucleobases are stacked head‐to‐tail. The methanol solvent mol­ecule forms hydrogen bonds with both the nucleobase and the sugar moiety.
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