Prescher, Horst, Koch, Guido, Schuhmann, Tim, Ertl, Peter, Bussenault, Alex, Glick, Meir, Dix, Ina and Lizos, Dimitrios (2016) Construction of a 3D-shaped, natural product like fragment library by fragmentation and diversification of natural products. Bioorganic and medicinal chemistry. ISSN 09680896

Abstract

A fragment library consisting of 3D-shaped, natural product-like fragments was assembled. Library construction was mainly performed by natural product degradation and natural product diversification reactions and was complemented by the identification of 3D-shaped, natural product like fragments available from commercial sources. In addition, during the course of these studies, novel rearrangements were discovered for Massarigenin C and Cytochalasin E. The obtained fragment library has an excellent 3D-shape and natural product likeness, covering an underexplored and underrepresented chemical space in fragment based drug discovery (FBDD).

Item Type:	Article
Date Deposited:	14 Dec 2016 00:45
Last Modified:	14 Dec 2016 00:45
URI:	https://oak.novartis.com/id/eprint/31236