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Correlation of Spectral, Molecular
Modelling with Biological Activity of Certain Trioxanes
related to
Qinghaosu
Research
team: F. M. D. Ismail, and Dr P Carr
Programme of studies: Artemisinin is an antimalarial compound
that has other biological activities such as healing psoriatic
lesions. Importantly, biological activity data correlated with
structure (using molecular modelling), Using a diverse range of 1,2-dioxolanes and 1,2,4-trioxanes,revealed
minimum pharmacophoric requirements whilst maintaining biopotency. This approach
has been succesfully used to identify several
new potent antimalarials constructed using radical cascade reactions. Products
are characterised using multidimensional high field 2-D NMR experiments. |
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