2. Academic Validation
  3. Synthesis and structural assignment of two major metabolites of the LTA4H inhibitor DG-051

Synthesis and structural assignment of two major metabolites of the LTA4H inhibitor DG-051

  • Bioorg Med Chem Lett. 2009 Nov 15;19(22):6275-9. doi: 10.1016/j.bmcl.2009.09.097.
Livia A Enache 1,  Jun Zhang,  David W Sullins,  Isaac Kennedy,  Emmanuel Onua,  David E Zembower,  Frank W Muellner,  Jasbir Singh,  Alex S Kiselyov
Affiliations

Affiliation

  • 1 DeCODE Chemistry, Inc., 2501 Davey Road, Woodridge, IL 60517, USA. lenache@decode.com
PMID: 19819140 DOI: 10.1016/j.bmcl.2009.09.097
Abstract

The same two major CYP mediated metabolites of DG-051 were produced in the presence of rat, dog, monkey and human liver microsomes. Their respective structures were hypothesized based on mass spectrometry data correlated with the parent structure and confirmed by comparison with authentic synthetic samples. The number of regioisomers synthesized as candidates for metabolite M1 was narrowed down using a metabolic study of a selectively deuterated DG-051 analogue.

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