Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents
The cytotoxicity of isosteviol and its twenty derivatives on three human tumor cell lines (ECA-109, MCF-7 and B16-F10) were evaluated. The results demonstrated that ECA-109 was the most sensitive cell line which was exposed to the compound ( VI ) with the lowest IC 50 value of 1.30 ± 0.11 μM. By qua...
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| Veröffentlicht in: | Russian journal of bioorganic chemistry 2021, Vol.47 (1), p.288-298 |
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| container_title | Russian journal of bioorganic chemistry |
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| creator | Cong-Jun Liu Wang, Yu-Fei Yao, Jian-Hua Liu, Yan-Ping Jiang, Qiao-Juan Liu, Pan-Ping |
| description | The cytotoxicity of isosteviol and its twenty derivatives on three human tumor cell lines (ECA-109, MCF-7 and B16-F10) were evaluated. The results demonstrated that ECA-109 was the most sensitive cell line which was exposed to the compound (
VI
) with the lowest IC
50
value of 1.30 ± 0.11 μM. By quantitative structure–activity relationship (QSAR) technique, the obtained cytotoxicity data were further utilized to respectively generate the statistically reliable HQSAR model (
q
2
= 0.828,
r
2
= 0.941,
= 0.849) and topomer CoMFA model (
q
2
= 0.608,
r
2
= 0.919,
= 0.747), which could provide the guidelines for the further development of novel and potent anti-esophageal agent. |
| doi_str_mv | 10.1134/S106816202101012X |
| format | Article |
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VI
) with the lowest IC
50
value of 1.30 ± 0.11 μM. By quantitative structure–activity relationship (QSAR) technique, the obtained cytotoxicity data were further utilized to respectively generate the statistically reliable HQSAR model (
q
2
= 0.828,
r
2
= 0.941,
= 0.849) and topomer CoMFA model (
q
2
= 0.608,
r
2
= 0.919,
= 0.747), which could provide the guidelines for the further development of novel and potent anti-esophageal agent.</description><identifier>ISSN: 1068-1620</identifier><identifier>EISSN: 1608-330X</identifier><identifier>DOI: 10.1134/S106816202101012X</identifier><language>eng</language><publisher>Moscow: Pleiades Publishing</publisher><subject>Biochemistry ; Biomedical and Life Sciences ; Biomedicine ; Bioorganic Chemistry ; Biotechnology ; Cytotoxicity ; Esophagus ; Life Sciences ; Organic Chemistry ; Toxicity</subject><ispartof>Russian journal of bioorganic chemistry, 2021, Vol.47 (1), p.288-298</ispartof><rights>Pleiades Publishing, Ltd. 2021. ISSN 1068-1620, Russian Journal of Bioorganic Chemistry, 2021, Vol. 47, No. 1, pp. 288–298. © Pleiades Publishing, Ltd., 2021.</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c316t-88a4af8461db9e4e6cfbadc3f065b7b39faea69b8cf2a62e63b37d4e9f056a6d3</citedby><cites>FETCH-LOGICAL-c316t-88a4af8461db9e4e6cfbadc3f065b7b39faea69b8cf2a62e63b37d4e9f056a6d3</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://link.springer.com/content/pdf/10.1134/S106816202101012X$$EPDF$$P50$$Gspringer$$H</linktopdf><linktohtml>$$Uhttps://link.springer.com/10.1134/S106816202101012X$$EHTML$$P50$$Gspringer$$H</linktohtml><link.rule.ids>314,780,784,27924,27925,41488,42557,51319</link.rule.ids></links><search><creatorcontrib>Cong-Jun Liu</creatorcontrib><creatorcontrib>Wang, Yu-Fei</creatorcontrib><creatorcontrib>Yao, Jian-Hua</creatorcontrib><creatorcontrib>Liu, Yan-Ping</creatorcontrib><creatorcontrib>Jiang, Qiao-Juan</creatorcontrib><creatorcontrib>Liu, Pan-Ping</creatorcontrib><title>Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents</title><title>Russian journal of bioorganic chemistry</title><addtitle>Russ J Bioorg Chem</addtitle><description>The cytotoxicity of isosteviol and its twenty derivatives on three human tumor cell lines (ECA-109, MCF-7 and B16-F10) were evaluated. The results demonstrated that ECA-109 was the most sensitive cell line which was exposed to the compound (
VI
) with the lowest IC
50
value of 1.30 ± 0.11 μM. By quantitative structure–activity relationship (QSAR) technique, the obtained cytotoxicity data were further utilized to respectively generate the statistically reliable HQSAR model (
q
2
= 0.828,
r
2
= 0.941,
= 0.849) and topomer CoMFA model (
q
2
= 0.608,
r
2
= 0.919,
= 0.747), which could provide the guidelines for the further development of novel and potent anti-esophageal agent.</description><subject>Biochemistry</subject><subject>Biomedical and Life Sciences</subject><subject>Biomedicine</subject><subject>Bioorganic Chemistry</subject><subject>Biotechnology</subject><subject>Cytotoxicity</subject><subject>Esophagus</subject><subject>Life Sciences</subject><subject>Organic Chemistry</subject><subject>Toxicity</subject><issn>1068-1620</issn><issn>1608-330X</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2021</creationdate><recordtype>article</recordtype><recordid>eNp1kE9LAzEQxYMoWKsfwFvA82r-7KbZ49JWLRREq9Dbkt2d1JS6WZN0sd_eLBU8iMxhhnnv9wYGoWtKbinl6d2KEiGpYIRREoutT9CICiITzsn6NM5RTgb9HF14vyXRRDI5QjA9BBvsl6lxUQfTm2DAY9U2-HlVvOBV2DfDwmo8MwFcB601DV546wP0xu7wDJzpVSQHzOOiDSaZe9u9qw2oHS420AZ_ic602nm4-ulj9HY_f50-Jsunh8W0WCY1pyIkUqpUaZkK2lQ5pCBqXamm5pqIrJpUPNcKlMgrWWumBAPBKz5pUsg1yYQSDR-jm2Nu5-znHnwot3bv2niyZBnhLBeS8eiiR1ftrPcOdNk586HcoaSkHL5Z_vlmZNiR8dHbbsD9Jv8PfQPSangv</recordid><startdate>2021</startdate><enddate>2021</enddate><creator>Cong-Jun Liu</creator><creator>Wang, Yu-Fei</creator><creator>Yao, Jian-Hua</creator><creator>Liu, Yan-Ping</creator><creator>Jiang, Qiao-Juan</creator><creator>Liu, Pan-Ping</creator><general>Pleiades Publishing</general><general>Springer Nature B.V</general><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>2021</creationdate><title>Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents</title><author>Cong-Jun Liu ; Wang, Yu-Fei ; Yao, Jian-Hua ; Liu, Yan-Ping ; Jiang, Qiao-Juan ; Liu, Pan-Ping</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c316t-88a4af8461db9e4e6cfbadc3f065b7b39faea69b8cf2a62e63b37d4e9f056a6d3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2021</creationdate><topic>Biochemistry</topic><topic>Biomedical and Life Sciences</topic><topic>Biomedicine</topic><topic>Bioorganic Chemistry</topic><topic>Biotechnology</topic><topic>Cytotoxicity</topic><topic>Esophagus</topic><topic>Life Sciences</topic><topic>Organic Chemistry</topic><topic>Toxicity</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Cong-Jun Liu</creatorcontrib><creatorcontrib>Wang, Yu-Fei</creatorcontrib><creatorcontrib>Yao, Jian-Hua</creatorcontrib><creatorcontrib>Liu, Yan-Ping</creatorcontrib><creatorcontrib>Jiang, Qiao-Juan</creatorcontrib><creatorcontrib>Liu, Pan-Ping</creatorcontrib><collection>CrossRef</collection><jtitle>Russian journal of bioorganic chemistry</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Cong-Jun Liu</au><au>Wang, Yu-Fei</au><au>Yao, Jian-Hua</au><au>Liu, Yan-Ping</au><au>Jiang, Qiao-Juan</au><au>Liu, Pan-Ping</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents</atitle><jtitle>Russian journal of bioorganic chemistry</jtitle><stitle>Russ J Bioorg Chem</stitle><date>2021</date><risdate>2021</risdate><volume>47</volume><issue>1</issue><spage>288</spage><epage>298</epage><pages>288-298</pages><issn>1068-1620</issn><eissn>1608-330X</eissn><abstract>The cytotoxicity of isosteviol and its twenty derivatives on three human tumor cell lines (ECA-109, MCF-7 and B16-F10) were evaluated. The results demonstrated that ECA-109 was the most sensitive cell line which was exposed to the compound (
VI
) with the lowest IC
50
value of 1.30 ± 0.11 μM. By quantitative structure–activity relationship (QSAR) technique, the obtained cytotoxicity data were further utilized to respectively generate the statistically reliable HQSAR model (
q
2
= 0.828,
r
2
= 0.941,
= 0.849) and topomer CoMFA model (
q
2
= 0.608,
r
2
= 0.919,
= 0.747), which could provide the guidelines for the further development of novel and potent anti-esophageal agent.</abstract><cop>Moscow</cop><pub>Pleiades Publishing</pub><doi>10.1134/S106816202101012X</doi><tpages>11</tpages></addata></record> |
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| ispartof | Russian journal of bioorganic chemistry, 2021, Vol.47 (1), p.288-298 |
| issn | 1068-1620 1608-330X |
| language | eng |
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| source | SpringerLink Journals - AutoHoldings |
| subjects | Biochemistry Biomedical and Life Sciences Biomedicine Bioorganic Chemistry Biotechnology Cytotoxicity Esophagus Life Sciences Organic Chemistry Toxicity |
| title | Cytotoxic Activities and QSAR Studies of Diterpenoid Isosteviol Derivatives as Anti-Esophageal Agents |
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