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苯基 2,3,4-三-O-苄基-1-硫代-α-D-甘露吡喃糖苷一水合物

Phenyl 2,3,4-tri-O-benzyl-1-thio-α-d-mannopyran-oside monohydrate.

作者信息

Durka Maxime, Norberg Bernadette, Roué Yvain, Vincent Stéphane P, Wouters Johan

机构信息

Department of Chemistry, University of Namur, 61 Rue de Bruxelles, B-5000 Namur, Belgium.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 5;66(Pt 7):o1525. doi: 10.1107/S1600536810019604.

Abstract

In the title compound, C(33)H(34)O(5)S·H(2)O, the mannopyran-oside ring adopts a chair conformation with the 2-α-thio-phenyl group occupying an axial position. One of the pendant benzyl groups is disordered over two sets of sites in a 0.5:0.5 ratio. In the crystal, the water mol-ecule makes two O-H⋯O hydrogen bonds to an adjacent sugar mol-ecule with the O atoms of the primary alcohol and ether groups acting as acceptors. At the same time, the OH group of the sugar makes a hydrogen bond to a water mol-ecule.

摘要

在标题化合物C(33)H(34)O(5)S·H(2)O中,甘露吡喃糖苷环呈椅式构象,2-α-硫代苯基处于轴向位置。一个侧链苄基在两组位置上无序排列,比例为0.5:0.5。在晶体中,水分子与相邻的糖分子形成两个O-H⋯O氢键,伯醇基团和醚基团的O原子作为受体。同时,糖的OH基团与一个水分子形成氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4764/3006854/bb59ac4561ff/e-66-o1525-fig1.jpg

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