Synthesis, Characterization, and Docking Study of a Novel Indole Derivative Containing a Tosyl Moiety as Anti-Oxidant Agent

Molbank Pub Date : 2024-07-26 DOI:10.3390/m1857
Abdelali Chihab, N. El Brahmi, S. El Kazzouli
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Abstract

Indole derivatives are key components of natural products and possess a wide range of biological and pharmaceutical applications. Here, we present the synthesis of a new indole derivative, namely 2-(1-ethyl-5-nitro-1H-indole-7-carbonyl)butyl 4-methylbenzenesulfonate. The structural elucidation of this compound was accomplished through comprehensive spectroscopic analysis, including Fourier-transform infrared spectroscopy (FTIR), nuclear magnetic resonance (NMR), and high-resolution mass spectrometry (HRMS). Our molecular docking study revealed that this compound exhibits strong affinity towards tyrosinase, making it a promising candidate as an antioxidant agent.
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含对甲苯磺酰基的新型吲哚衍生物作为抗氧化剂的合成、表征和 Docking 研究
吲哚衍生物是天然产物的关键成分,具有广泛的生物和医药用途。在此,我们合成了一种新的吲哚衍生物,即 2-(1-乙基-5-硝基-1H-吲哚-7-甲酰基)丁基 4-甲基苯磺酸酯。我们通过傅立叶变换红外光谱(FTIR)、核磁共振(NMR)和高分辨质谱(HRMS)等综合光谱分析,对该化合物的结构进行了阐明。分子对接研究表明,该化合物对酪氨酸酶具有很强的亲和力,因此有望成为一种抗氧化剂。
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