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基于酰肼的自组装纳米通道:高效的水转运和盐截留

Self-Assembled Hydrazide-Based Nanochannels: Efficient Water Translocation and Salt Rejection.

作者信息

Mondal Abhishek, Mondal Debashis, Sarkar Susmita, Shivpuje Umesh, Mondal Jagannath, Talukdar Pinaki

机构信息

Department of Chemistry, Indian Institute of Science Education and Research Pune, Dr. Homi Bhabha Road, Pashan, Pune, 411008, Maharashtra, India.

Present Address: Leiden Institute of Chemistry, Leiden University, 2333, CC Leiden, The Netherlands.

出版信息

Angew Chem Int Ed Engl. 2025 Jan 15;64(3):e202415510. doi: 10.1002/anie.202415510. Epub 2024 Oct 22.

Abstract

Nature has ingeniously developed specialized water transporters that effectively reject ions, including protons, while transporting water across membranes. These natural water channels, known as aquaporins (AQPs), have inspired the creation of Artificial Water Channels (AWCs). However, replicating superfast water transport with synthetic molecular structures that exclude salts and protons is a challenging task. This endeavor demands the coexistence of a suitable water-binding site and a selective filter for precise water transportation. Here, we present small-molecule hydrazides 1 b-1 d that self-assemble into a rosette-type nanochannel assembly through intermolecular hydrogen bonding and π-π stacking interactions, and selectively transport water molecules across lipid bilayer membranes. The experimental analysis demonstrates notable permeability rates for the 1 c derivative, enabling approximately 3.18×10 water molecules to traverse the channel per second. This permeability rate is about one order of magnitude lower than that of AQPs. Of particular significance, the 1 c ensures exclusive passage of water molecules while effectively blocking salts and protons. MD simulation studies confirmed the stability and water transport properties of the water channel assembly inside the bilayer membranes at ambient conditions.

摘要

大自然巧妙地开发出了专门的水转运蛋白,这些蛋白在跨膜运输水的同时能有效排斥包括质子在内的离子。这些被称为水通道蛋白(AQPs)的天然水通道激发了人工水通道(AWCs)的创造。然而,用能够排斥盐分和质子的合成分子结构来复制超快水运输是一项具有挑战性的任务。这项工作需要一个合适的水结合位点和一个选择性过滤器共存,以实现精确的水运输。在此,我们展示了小分子酰肼1 b - 1 d,它们通过分子间氢键和π-π堆积相互作用自组装成玫瑰花结型纳米通道组件,并能选择性地跨脂质双分子层膜运输水分子。实验分析表明1 c衍生物具有显著的渗透率,每秒约有3.18×10个水分子穿过该通道。这个渗透率比水通道蛋白的渗透率低约一个数量级。特别重要的是,1 c能确保水分子的独家通过,同时有效阻挡盐分和质子。分子动力学模拟研究证实了该水通道组件在环境条件下于双分子层膜内的稳定性和水运输特性。

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