ChemInform Abstract: Tunable Phosphine-Mediated Domino Reaction: Selective Synthesis of 2,3-Dihydrofurans and Biaryls.

ChemInform ◽  
2013 ◽  
Vol 44 (24) ◽  
pp. no-no
Author(s):  
Peizhong Xie ◽  
Erqing Li ◽  
Jie Zheng ◽  
Xin Li ◽  
You Huang ◽  
...  
Keyword(s):  
Domino Reaction ◽  
Selective Synthesis

New domino reaction for the selective synthesis of tetracyclic cinnolino[5,4,3-cde]cinnolines

2009 ◽  
Vol 7 (6) ◽  
pp. 1171 ◽  
Author(s):  
Bo Jiang ◽  
Wen-Juan Hao ◽  
Jin-Peng Zhang ◽  
Shu-Jiang Tu ◽  
Feng Shi
Keyword(s):  
Domino Reaction ◽  
Selective Synthesis

Highly selective synthesis of functionalized polyhydroisoquinoline derivatives via a three-component domino reaction

2015 ◽  
Vol 51 (8) ◽  
pp. 1528-1531 ◽  
Author(s):  
Xian Feng ◽  
Jian-Jun Wang ◽  
Zhan Xun ◽  
Juan-Juan Zhang ◽  
Zhi-Bin Huang ◽  
...  
Keyword(s):  
Microwave Irradiation ◽  
Domino Reaction ◽  
Selective Synthesis

Two series of novel functionalized polyhydroisoquinoline derivatives have been synthesized via the three-component domino reaction under microwave irradiation conditions.

Selective synthesis of polyfunctionalized hydroisoquinoline derivatives via a three-component domino reaction

RSC Advances ◽  
2014 ◽  
Vol 4 (107) ◽  
pp. 62457-62464 ◽  
Author(s):  
Juan-Juan Zhang ◽  
Jun-Die Hu ◽  
Cheng-Pao Cao ◽  
Guo-Lan Dou ◽  
Lei Fu ◽  
...  
Keyword(s):  
Microwave Irradiation ◽  
Domino Reaction ◽  
Selective Synthesis

Two series of novel polyfunctionalized hydroisoquinoline derivatives have been synthesized via a three-component domino reaction under microwave irradiation conditions.

ChemInform Abstract: New Domino Reaction for the Selective Synthesis of Tetracyclic Cinnolino[5,4,3-cde]cinnolines.

ChemInform ◽  
2009 ◽  
Vol 40 (30) ◽  
Author(s):  
Bo Jiang ◽  
Wen-Juan Hao ◽  
Jin-Peng Zhang ◽  
Shu-Jiang Tu ◽  
Feng Shi
Keyword(s):  
Domino Reaction ◽  
Selective Synthesis

Tunable Phosphine-Mediated Domino Reaction: Selective Synthesis of 2,3-Dihydrofurans and Biaryls

2012 ◽  
Vol 355 (1) ◽  
pp. 161-169 ◽  
Author(s):  
Peizhong Xie ◽  
Erqing Li ◽  
Jie Zheng ◽  
Xin Li ◽  
You Huang ◽  
...  
Keyword(s):  
Domino Reaction ◽  
Selective Synthesis

ChemInform Abstract: Highly Selective Synthesis of Functionalized Polyhydroisoquinoline Derivatives via a Three-Component Domino Reaction.

ChemInform ◽  
2015 ◽  
Vol 46 (25) ◽  
pp. no-no
Author(s):  
Xian Feng ◽  
Jian-Jun Wang ◽  
Zhan Xun ◽  
Juan-Juan Zhang ◽  
Zhi-Bin Huang ◽  
...  
Keyword(s):  
Domino Reaction ◽  
Selective Synthesis

RetroBioCat: Computer-Aided Synthesis Planning for Biocatalytic Reactions and Cascades

2020 ◽  
Author(s):  
William Finnigan ◽  
Lorna J. Hepworth ◽  
Nicholas J. Turner ◽  
Sabine Flitsch
Keyword(s):  
Organic Chemistry ◽  
Computer Aided Design ◽  
Selective Synthesis ◽  
Test Set ◽  
Synthesis Design ◽  
Computer Aided ◽  
Synthesis Planning ◽  
Enzymatic Cascades ◽  
Target Molecules ◽  
Aided Design

As the enzyme toolbox for biocatalysis has expanded, so has the potential for the construction of powerful enzymatic cascades for efficient and selective synthesis of target molecules. Additionally, recent advances in computer-aided synthesis planning (CASP) are revolutionizing synthesis design in both synthetic biology and organic chemistry. However, the potential for biocatalysis is not well captured by tools currently available in either field. Here we present RetroBioCat, an intuitive and accessible tool for computer-aided design of biocatalytic cascades, freely available at retrobiocat.com. Our approach uses a set of expertly encoded reaction rules encompassing the enzyme toolbox for biocatalysis, and a system for identifying literature precedent for enzymes with the correct substrate specificity where this is available. Applying these rules for automated biocatalytic retrosynthesis, we show our tool to be capable of identifying promising biocatalytic pathways to target molecules, validated using a test-set of recent cascades described in the literature.

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