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Diversity-oriented photobiocatalytic synthesis via stereoselective three-component radical coupling

Chen Zhang, Jun Zhou, Pei‐Pei Xie, Silvia M. Rivera, Turki M. Alturaifi, James Finnigan, Simon J. Charnock, Peng Liu, Yang Yang

2025Science29 citationsDOIOpen Access PDF

Abstract

Enzymatic multicomponent carbon-carbon (C-C) bond-forming reactions for diversity-oriented synthesis remain rare. Using cooperative photobiocatalysis, we developed a stereoselective three-component radical-mediated C-C coupling previously unknown in both organic chemistry and biochemistry. Directed evolution of repurposed pyridoxal decarboxylases enabled full fragment variability in this three-component coupling, giving rise to six classes of valuable products, many of which were inaccessible with other methods, even in a racemic fashion. This enzymatic platform integrates a range of asymmetric catalysis principles, including remote stereocenter construction, stereodivergent catalysis, kinetic resolution, and parallel kinetic resolution, achieving excellent diastereo- and enantiocontrol over radical intermediates. The broad substrate scope and complementary specificities of evolved enzyme variants enabled combinatorial library synthesis, affording structurally and stereochemically diverse scaffolds for medicinal chemistry.

Topics & Concepts

Kinetic resolutionStereocenterStereoselectivityChemistryCombinatorial chemistrySubstrate (aquarium)StereochemistryCatalysisEnantioselective synthesisSubstrate specificityComponent (thermodynamics)EnzymeOrganic chemistryBiologyPhysicsEcologyThermodynamicsRadical Photochemical ReactionsCatalytic C–H Functionalization MethodsClick Chemistry and Applications