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This study explores the inhibitory effects of phenyl\u2010\u03b2\u2010D\u2010pyranoglucoside (compound <jats:bold>1<\/jats:bold>), 4\u2010methoxyphenyl\u2010\u03b2\u2010D\u2010pyranoglucoside (compound <jats:bold>2<\/jats:bold>), 4\u2010hydroxymethylphenyl\u2010\u03b2\u2010D\u2010pyranoglucoside (compound <jats:bold>3<\/jats:bold>), and \u03b2\u2010arbutin (compound 4) on tyrosinase using enzyme kinetics, molecular docking, and molecular dynamics simulations. Results show compounds <jats:bold>1<\/jats:bold>, <jats:bold>3<\/jats:bold>, and <jats:bold>4<\/jats:bold> exhibit competitive inhibition, while compound <jats:bold>2<\/jats:bold> shows mixed inhibition. Docking analysis reveals phenyl rings of all compounds interact with the enzyme's active site, with compound <jats:bold>3<\/jats:bold> forming a metal bond with copper ions. MD simulations indicate high stability for compounds <jats:bold>2<\/jats:bold>, <jats:bold>3<\/jats:bold>, and <jats:bold>4<\/jats:bold>, with compound <jats:bold>3<\/jats:bold> showing the lowest RMSD and compact Rg, suggesting stronger binding. Compound <jats:bold>1<\/jats:bold> is less stable and less inhibitory. These insights are valuable for designing effective tyrosinase inhibitors.<\/jats:p>","DOI":"10.1002\/cbdv.202402040","type":"journal-article","created":{"date-parts":[[2024,10,7]],"date-time":"2024-10-07T18:08:31Z","timestamp":1728324511000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":6,"title":["Investigation of the Inhibitory Activity of <i>\u03b2<\/i>\u2010Arbutin and its Analogues on Tyrosinase Based on Molecular Docking and Enzyme Inhibition Kinetics"],"prefix":"10.1002","volume":"22","author":[{"given":"Yuxiu","family":"Lv","sequence":"first","affiliation":[{"name":"Key Laboratory of National Forestry and Grassland Administration on Highly-Efficient Utilization of Forestry Biomass Resources in Southwest China Southwest Forestry University  Kunming Yunnan 650224 PR China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Chuanhui","family":"Yao","sequence":"additional","affiliation":[{"name":"Key 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