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Computational Study on the Conformations of Mitragynine and Mitragynaline

Haining Liu1, Christopher R McCurdy, Robert J Doerksen

  • 1Department of Medicinal Chemistry, University of Mississippi, MS, 38677-1848, USA.

Theochem
|February 5, 2011
PubMed
Summary

Computational methods revealed distinct conformational preferences for mitragynine and mitragynaline, natural products from Mitragyna speciosa. Mitragynine exhibits lower energy in a syn conformation due to reduced steric hindrance, aligning with crystal data.

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