2023
Data Science-Enabled Palladium-Catalyzed Enantioselective Aryl-Carbonylation of Sulfonimidamides
van Dijk L, Haas B, Lim N, Clagg K, Dotson J, Treacy S, Piechowicz K, Roytman V, Zhang H, Toste F, Miller S, Gosselin F, Sigman M. Data Science-Enabled Palladium-Catalyzed Enantioselective Aryl-Carbonylation of Sulfonimidamides. Journal Of The American Chemical Society 2023, 145: 20959-20967. PMID: 37656964, DOI: 10.1021/jacs.3c06674.Peer-Reviewed Original ResearchCross-coupling methodsHeteroaryl iodidesLigand descriptorsExcellent yieldsCoupling partnersChemical spaceMedicinal chemistrySulfonimidamidesAgrochemical discoveryVirtual libraryReaction optimizationOptimal conditionsEfficient strategyHeteroarylScience techniquesEnantioselectivityArylCatalystIodideReactionChemistryData science techniquesYieldDescriptorsDiverse set
2017
Applications of Nonenzymatic Catalysts to the Alteration of Natural Products
Shugrue CR, Miller SJ. Applications of Nonenzymatic Catalysts to the Alteration of Natural Products. Chemical Reviews 2017, 117: 11894-11951. PMID: 28580785, PMCID: PMC5742423, DOI: 10.1021/acs.chemrev.7b00022.Peer-Reviewed Original ResearchConceptsNatural productsNonenzymatic catalystsComplex molecular scaffoldsComplex natural productsH bond functionalizationC bond formationNatural product scaffoldsLate-stage functionalizationNatural product derivativesSynthesis of analoguesChemical functionalityMedicinal chemistryBond functionalizationElectrophilic reagentsOlefin functionalizationSelectivity challengesBiological activity assaysBond formationEnzymatic catalystsProduct derivativesMolecular scaffoldsCatalystComplex moleculesChemical remodelingSmall molecules