Chemical synthesis and biological evaluation of cis- and trans-12,13-cyclopropyl and 12,13-cyclobutyl epothilones and related pyridine side chain analogues

Research output: Contribution to journalJournal articleResearchpeer-review

  • K C Nicolaou
  • K Namoto
  • A Ritzén
  • Ulven, Trond
  • M Shoji
  • J Li
  • G D'Amico
  • D Liotta
  • C T French
  • M Wartmann
  • K H Altmann
  • P Giannakakou
The design, chemical synthesis, and biological evaluation of a series of cyclopropyl and cyclobutyl epothilone analogues (3-12, Figure 1) are described. The synthetic strategies toward these epothilones involved a Nozaki-Hiyama-Kishi coupling to form the C15-C16 carbon-carbon bond, an aldol reaction to construct the C6-C7 carbon-carbon bond, and a Yamaguchi macrolactonization to complete the required skeletal framework. Biological studies with the synthesized compounds led to the identification of epothilone analogues 3, 4, 7, 8, 9, and 11 as potent tubulin polymerization promoters and cytotoxic agents with (12R,13S,15S)-cyclopropyl 5-methylpyridine epothilone A (11) as the most powerful compound whose potencies (e.g. IC(50) = 0.6 nM against the 1A9 ovarian carcinoma cell line) approach those of epothilone B. These investigations led to a number of important structure-activity relationships, including the conclusion that neither the epoxide nor the stereochemistry at C12 are essential, while the stereochemistry at both C13 and C15 are crucial for biological activity. These studies also confirmed the importance of both the cyclopropyl and 5-methylpyridine moieties in conferring potent and potentially clinically useful biological properties to the epothilone scaffold.
Original languageEnglish
JournalAmerican Chemical Society. Journal
Volume123
Issue number38
Pages (from-to)9313-9323
Number of pages11
ISSN0002-7863
Publication statusPublished - 26 Sep 2001

    Research areas

  • Antineoplastic Agents, Carcinoma, Squamous Cell, Drug Screening Assays, Antitumor, Epoxy Compounds, Female, Humans, Ovarian Neoplasms, Pyridines, Thiazoles, Tubulin, Tumor Cells, Cultured

ID: 189160747