Article
Design and Synthesis of Natural Product Inspired Libraries Based on the Three-Dimensional (3D) Cedrane Scaffold: Toward the Exploration of 3D Biological Space.
Journal of medicinal chemistry - 9 Aug 2018
Mazraati Tajabadi Fatemeh, Pouwer Rebecca H, Liu Miaomiao, Dashti Yousef, Campitelli Marc R, Murtaza Mariyam, Mellick George D, Wood Stephen A, Jenkins Ian D, Quinn Ronald J
Abstract excerpt
A chemoinformatic method was developed to extract nonflat scaffolds embedded in natural products within the Dictionary of Natural Products (DNP). The cedrane scaffold was then chosen as an example of a nonflat scaffold that directs substituents in three-dimensional (3D) space. A cedrane scaffold that has three orthogonal handles to allow generation of 1D, 2D, and 3D libraries was synthesized on a large scale....
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