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An integrated console for capsule-based, automated organic synthesis

The current laboratory practices of organic synthesis are labor intensive, impose safety and environmental hazards, and hamper the implementation of artificial intelligence guided drug discovery. Using a combination of reagent design, hardware engineering, and a simple operating system we provide an...

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Detalles Bibliográficos
Autores principales: Jiang, Tuo, Bordi, Samuele, McMillan, Angus E., Chen, Kuang-Yen, Saito, Fumito, Nichols, Paula L., Wanner, Benedikt M., Bode, Jeffrey W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8153237/
https://www.ncbi.nlm.nih.gov/pubmed/34123325
http://dx.doi.org/10.1039/d1sc01048d
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author Jiang, Tuo
Bordi, Samuele
McMillan, Angus E.
Chen, Kuang-Yen
Saito, Fumito
Nichols, Paula L.
Wanner, Benedikt M.
Bode, Jeffrey W.
author_facet Jiang, Tuo
Bordi, Samuele
McMillan, Angus E.
Chen, Kuang-Yen
Saito, Fumito
Nichols, Paula L.
Wanner, Benedikt M.
Bode, Jeffrey W.
author_sort Jiang, Tuo
collection PubMed
description The current laboratory practices of organic synthesis are labor intensive, impose safety and environmental hazards, and hamper the implementation of artificial intelligence guided drug discovery. Using a combination of reagent design, hardware engineering, and a simple operating system we provide an instrument capable of executing complex organic reactions with prepacked capsules. The machine conducts coupling reactions and delivers the purified products with minimal user involvement. Two desirable reaction classes – the synthesis of saturated N-heterocycles and reductive amination – were implemented, along with multi-step sequences that provide drug-like organic molecules in a fully automated manner. We envision that this system will serve as a console for developers to provide synthetic methods as integrated, user-friendly packages for conducting organic synthesis in a safe and convenient fashion.
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spelling pubmed-81532372021-06-11 An integrated console for capsule-based, automated organic synthesis Jiang, Tuo Bordi, Samuele McMillan, Angus E. Chen, Kuang-Yen Saito, Fumito Nichols, Paula L. Wanner, Benedikt M. Bode, Jeffrey W. Chem Sci Chemistry The current laboratory practices of organic synthesis are labor intensive, impose safety and environmental hazards, and hamper the implementation of artificial intelligence guided drug discovery. Using a combination of reagent design, hardware engineering, and a simple operating system we provide an instrument capable of executing complex organic reactions with prepacked capsules. The machine conducts coupling reactions and delivers the purified products with minimal user involvement. Two desirable reaction classes – the synthesis of saturated N-heterocycles and reductive amination – were implemented, along with multi-step sequences that provide drug-like organic molecules in a fully automated manner. We envision that this system will serve as a console for developers to provide synthetic methods as integrated, user-friendly packages for conducting organic synthesis in a safe and convenient fashion. The Royal Society of Chemistry 2021-04-13 /pmc/articles/PMC8153237/ /pubmed/34123325 http://dx.doi.org/10.1039/d1sc01048d Text en This journal is © The Royal Society of Chemistry https://creativecommons.org/licenses/by/3.0/
spellingShingle Chemistry
Jiang, Tuo
Bordi, Samuele
McMillan, Angus E.
Chen, Kuang-Yen
Saito, Fumito
Nichols, Paula L.
Wanner, Benedikt M.
Bode, Jeffrey W.
An integrated console for capsule-based, automated organic synthesis
title An integrated console for capsule-based, automated organic synthesis
title_full An integrated console for capsule-based, automated organic synthesis
title_fullStr An integrated console for capsule-based, automated organic synthesis
title_full_unstemmed An integrated console for capsule-based, automated organic synthesis
title_short An integrated console for capsule-based, automated organic synthesis
title_sort integrated console for capsule-based, automated organic synthesis
topic Chemistry
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8153237/
https://www.ncbi.nlm.nih.gov/pubmed/34123325
http://dx.doi.org/10.1039/d1sc01048d
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