{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,30]],"date-time":"2026-07-30T16:52:01Z","timestamp":1785430321334,"version":"3.56.0"},"reference-count":61,"publisher":"MDPI AG","issue":"5","license":[{"start":{"date-parts":[[2026,5,14]],"date-time":"2026-05-14T00:00:00Z","timestamp":1778716800000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"funder":[{"DOI":"10.13039\/501100003069","name":"Instituto Polit\u00e9cnico Nacional","doi-asserted-by":"publisher","award":["SIP 20260221"],"award-info":[{"award-number":["SIP 20260221"]}],"id":[{"id":"10.13039\/501100003069","id-type":"DOI","asserted-by":"publisher"}]},{"award":["SIP 20260221"],"award-info":[{"award-number":["SIP 20260221"]}],"id":[{"id":"https:\/\/ror.org\/059sp8j34","id-type":"ROR","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Biomolecules"],"abstract":"<jats:p>Obesity and Non-Alcoholic Fatty Liver Disease (NAFLD) are closely linked and constitute a growing public health concern. In this work, we evaluated the antiobesity effect of an enantiomerically enriched mixture of 3\u2032,4\u2032-di-O-acetyl-cis-khellactone (DOAcK), a natural product derivative obtained by asymmetric synthesis. This molecule is a derivative of praeruptorin, a major component found in Arracacia tolucensis as well as many other species from the Apiaceae family. A comprehensive evaluation of DOAcK was conducted using both experimental and theoretical methods. DOAcK showed significant effects in animal models, with additional evidence of diminished expression of PPAR\u03b3. Finally, we conducted molecular modeling to elucidate the putative interaction between DOAcK and PPAR\u03b3, uncovering the significant role of the so-called \u03a9-loop, near the ligand binding domain. In summary, these positive findings of DOAcK demonstrate that the use of this natural product could be helpful in preventing NAFLD and obesity.<\/jats:p>","DOI":"10.3390\/biom16050724","type":"journal-article","created":{"date-parts":[[2026,5,21]],"date-time":"2026-05-21T16:46:18Z","timestamp":1779381978000},"page":"724","update-policy":"https:\/\/doi.org\/10.3390\/mdpi_crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Evaluation of 3\u2032,4\u2032-Di-O-acetyl-cis-khellactone as a Putative Antagonist of PPAR\u03b3 Using Experimental and Computational Modeling"],"prefix":"10.3390","volume":"16","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-1158-9896","authenticated-orcid":false,"given":"Elix Alberto","family":"Dom\u00ednguez-Mendoza","sequence":"first","affiliation":[{"name":"Departamento de Sistemas Biol\u00f3gicos, Universidad Aut\u00f3noma Metropolitana-X, Ciudad de M\u00e9xico 04960, Mexico"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-0054-0862","authenticated-orcid":false,"given":"Fernando Daniel","family":"Prieto-Mart\u00ednez","sequence":"additional","affiliation":[{"name":"Instituto de Ciencias F\u00edsicas, Universidad Nacional Aut\u00f3noma de M\u00e9xico, Av. Universidad s\/n, Col. Chamilpa, Cuernavaca 62210, Morelos, Mexico"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-0014-949X","authenticated-orcid":false,"given":"Yelzyn","family":"Galv\u00e1n-Cipr\u00e9s","sequence":"additional","affiliation":[{"name":"Departamento de Qu\u00edmica Org\u00e1nica, Escuela Nacional de Ciencias Biol\u00f3gicas, Instituto Polit\u00e9cnico Nacional, Ciudad de M\u00e9xico 07230, Mexico"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1108-7001","authenticated-orcid":false,"given":"Eleuterio","family":"Burgue\u00f1o-Tapia","sequence":"additional","affiliation":[{"name":"Departamento de Qu\u00edmica Org\u00e1nica, Escuela Nacional de Ciencias Biol\u00f3gicas, Instituto Polit\u00e9cnico Nacional, Ciudad de M\u00e9xico 07230, Mexico"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Cynthia","family":"Ordaz-Pichardo","sequence":"additional","affiliation":[{"name":"Escuela Nacional de Medicina y Homeopat\u00eda, Instituto Polit\u00e9cnico Nacional, Ciudad de M\u00e9xico 07230, Mexico"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"1968","published-online":{"date-parts":[[2026,5,14]]},"reference":[{"key":"ref_1","doi-asserted-by":"crossref","first-page":"473","DOI":"10.1007\/s11655-012-1120-0","article-title":"Natural products: A safest approach for obesity","volume":"18","author":"Vaduseva","year":"2012","journal-title":"Chin. 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