水溶液中观察到的稳定糖- NaCl -水配合物的1h NMR解析**

IF 6.1 Q1 CHEMISTRY, MULTIDISCIPLINARY Chemistry methods : new approaches to solving problems in chemistry Pub Date : 2023-04-19 DOI:10.1002/cmtd.202200063
Gan Zhu, Hui Li, Prof. Dr. Yiqun Li, Dr. Liuqun Gu
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引用次数: 0

摘要

糖在水介质中的溶剂化有助于理解生物系统和碳水化合物转化。众所周知,NaCl的存在会干扰糖水合物的氢键,然而,在原子水平上阐明机理的直接证据非常少,尽管“NaCl效应”在化学/生物燃料的生物质转化中众所周知。在此,我们报告了实验证据,在室温下,诱导的d -葡萄糖/果糖的1H NMR变化与NaCl水溶液浓度之间存在明显的阶梯状相关性;在体系中观察到两个稳定的键合状态。糖/NaCl水溶液中的HDO作为“动态”参考是在NaCl-糖相互作用的1H NMR研究中解耦全局盐效应的关键。通过进一步的半定量研究,首次在水溶液的原子水平上绘制了三个稳定的糖- nacl -水配合物的结构,以解决nacl -单糖相互作用。根据诱导1H NMR位移的最大值,提出了一个理想的NaCl用量。
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1H NMR Elucidation of Observed Stable Sugar-NaCl-water Complexes in Aqueous Solution**

The solvation of sugars in aqueous media matters in the understanding of biological systems and carbohydrate transformations. The presence of NaCl is known to perturb hydrogen bonding of sugar hydrates, however, direct evidence to elucidate mechanism at atom level is very rare even though the “NaCl Effect” was well known in biomass transformations for chemicals/biofuels. Here we report experimental evidences of a clear staircase-like correlation between induced 1H NMR changes of D-glucose/fructose with concentration of NaCl aqueous solution at room temperature; and two stable bonding status was observed in the system. HDO in sugar/NaCl aqueous solution as a “dynamic” reference is a key to enable decoupling the global salt effect in this 1H NMR investigation of NaCl-saccharide interaction. Via a further half-quantitative study, three structures of stable sugar-NaCl-water complexes were mapped for the first time in tackling the NaCl-monosaccharide interaction at atomic level in an aqueous solution. Based on the maximum of induced 1H NMR shifts, an ideal NaCl usage was proposed.

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