Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.
Identifieur interne : 000804 ( Main/Exploration ); précédent : 000803; suivant : 000805Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.
Auteurs : Lili Wang [République populaire de Chine] ; Shuangshuang Zhao [République populaire de Chine] ; Xiaotian Kong [République populaire de Chine] ; Lingling Cao [République populaire de Chine] ; Sheng Tian [République populaire de Chine] ; Yonghao Ye [République populaire de Chine] ; Chunhua Qiao [République populaire de Chine]Source :
- Bioorganic & medicinal chemistry [ 1464-3391 ] ; 2018.
Descripteurs français
- KwdFr :
- Antifongiques (composition chimique), Antifongiques (pharmacologie), Antifongiques (synthèse chimique), Champignons (effets des médicaments et des substances chimiques), Complexe III de la chaîne respiratoire (composition chimique), Complexe III de la chaîne respiratoire (métabolisme), Conception de médicament (MeSH), Fusarium (effets des médicaments et des substances chimiques), Relation structure-activité (MeSH), Simulation de docking moléculaire (MeSH), Sites de fixation (MeSH), Strobilurines (composition chimique), Strobilurines (pharmacologie), Strobilurines (synthèse chimique), Structure tertiaire des protéines (MeSH), Tests de sensibilité microbienne (MeSH), Thermodynamique (MeSH).
- MESH :
- composition chimique : Antifongiques, Complexe III de la chaîne respiratoire, Strobilurines.
- effets des médicaments et des substances chimiques : Champignons, Fusarium.
- métabolisme : Complexe III de la chaîne respiratoire.
- pharmacologie : Antifongiques, Strobilurines.
- synthèse chimique : Antifongiques, Strobilurines.
- Conception de médicament, Relation structure-activité, Simulation de docking moléculaire, Sites de fixation, Structure tertiaire des protéines, Tests de sensibilité microbienne, Thermodynamique.
English descriptors
- KwdEn :
- Antifungal Agents (chemical synthesis), Antifungal Agents (chemistry), Antifungal Agents (pharmacology), Binding Sites (MeSH), Drug Design (MeSH), Electron Transport Complex III (chemistry), Electron Transport Complex III (metabolism), Fungi (drug effects), Fusarium (drug effects), Microbial Sensitivity Tests (MeSH), Molecular Docking Simulation (MeSH), Protein Structure, Tertiary (MeSH), Strobilurins (chemical synthesis), Strobilurins (chemistry), Strobilurins (pharmacology), Structure-Activity Relationship (MeSH), Thermodynamics (MeSH).
- MESH :
- chemical , chemical synthesis : Antifungal Agents, Strobilurins.
- chemical , chemistry : Antifungal Agents, Electron Transport Complex III, Strobilurins.
- chemical , metabolism : Electron Transport Complex III.
- chemical , pharmacology : Antifungal Agents, Strobilurins.
- drug effects : Fungi, Fusarium.
- Binding Sites, Drug Design, Microbial Sensitivity Tests, Molecular Docking Simulation, Protein Structure, Tertiary, Structure-Activity Relationship, Thermodynamics.
Abstract
A series of novel pyraclostrobin derivatives were designed and prepared as antifungal agents. Their antifungal activities were tested in vitro with five important phytopathogenic fungi, namely, Batrylis cinerea, Phytophthora capsici, Fusarium sulphureum, Gloeosporium pestis and Sclerotinia sclerotiorum using the mycelium growth inhibition method. Among these compounds, 5s displayed IC50 value of 0.57 μg/mL against Batrylis cinerea and 5k-II displayed IC50 value of 0.43 μg/mL against Sclerotinia sclerotiorum, which were close to that of the positive control pyraclostrobin (0.18 μg/mL and 0.15 μg/mL). Other compounds 5f, 5k-II, 5j, 5m and 5s also exhibited strong antifungal activity. Further enzymatic assay demonstrated compound 5s inhibited porcine bc1 complex with IC50 value of 0.95 μM. The statistical results from an integrated computational pipeline demonstrated the predicted total binding free energy for compound 5s is the highest. Consequently, compound 5s with the biphenyl-4-methoxyl side chain could serve as a new motif as inhibitors of bc1 complex and deserve to be further investigated.
DOI: 10.1016/j.bmc.2018.01.004
PubMed: 29395803
Affiliations:
Links toward previous steps (curation, corpus...)
Le document en format XML
<record><TEI><teiHeader><fileDesc><titleStmt><title xml:lang="en">Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.</title><author><name sortKey="Wang, Lili" sort="Wang, Lili" uniqKey="Wang L" first="Lili" last="Wang">Lili Wang</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author><author><name sortKey="Zhao, Shuangshuang" sort="Zhao, Shuangshuang" uniqKey="Zhao S" first="Shuangshuang" last="Zhao">Shuangshuang Zhao</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Kong, Xiaotian" sort="Kong, Xiaotian" uniqKey="Kong X" first="Xiaotian" last="Kong">Xiaotian Kong</name><affiliation wicri:level="1"><nlm:affiliation>Institute of Functional Nano and Soft Materials (FUNSOM), Soochow University, Suzhou, Jiangsu 215123, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Institute of Functional Nano and Soft Materials (FUNSOM), Soochow University, Suzhou, Jiangsu 215123</wicri:regionArea><wicri:noRegion>Jiangsu 215123</wicri:noRegion></affiliation></author><author><name sortKey="Cao, Lingling" sort="Cao, Lingling" uniqKey="Cao L" first="Lingling" last="Cao">Lingling Cao</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Tian, Sheng" sort="Tian, Sheng" uniqKey="Tian S" first="Sheng" last="Tian">Sheng Tian</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: stian@suda.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author><author><name sortKey="Ye, Yonghao" sort="Ye, Yonghao" uniqKey="Ye Y" first="Yonghao" last="Ye">Yonghao Ye</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China. Electronic address: yeyh@njau.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Qiao, Chunhua" sort="Qiao, Chunhua" uniqKey="Qiao C" first="Chunhua" last="Qiao">Chunhua Qiao</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: qiaochunhua@suda.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author></titleStmt><publicationStmt><idno type="wicri:source">PubMed</idno><date when="2018">2018</date><idno type="RBID">pubmed:29395803</idno><idno type="pmid">29395803</idno><idno type="doi">10.1016/j.bmc.2018.01.004</idno><idno type="wicri:Area/Main/Corpus">000837</idno><idno type="wicri:explorRef" wicri:stream="Main" wicri:step="Corpus" wicri:corpus="PubMed">000837</idno><idno type="wicri:Area/Main/Curation">000837</idno><idno type="wicri:explorRef" wicri:stream="Main" wicri:step="Curation">000837</idno><idno type="wicri:Area/Main/Exploration">000837</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en">Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.</title><author><name sortKey="Wang, Lili" sort="Wang, Lili" uniqKey="Wang L" first="Lili" last="Wang">Lili Wang</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author><author><name sortKey="Zhao, Shuangshuang" sort="Zhao, Shuangshuang" uniqKey="Zhao S" first="Shuangshuang" last="Zhao">Shuangshuang Zhao</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Kong, Xiaotian" sort="Kong, Xiaotian" uniqKey="Kong X" first="Xiaotian" last="Kong">Xiaotian Kong</name><affiliation wicri:level="1"><nlm:affiliation>Institute of Functional Nano and Soft Materials (FUNSOM), Soochow University, Suzhou, Jiangsu 215123, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Institute of Functional Nano and Soft Materials (FUNSOM), Soochow University, Suzhou, Jiangsu 215123</wicri:regionArea><wicri:noRegion>Jiangsu 215123</wicri:noRegion></affiliation></author><author><name sortKey="Cao, Lingling" sort="Cao, Lingling" uniqKey="Cao L" first="Lingling" last="Cao">Lingling Cao</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Tian, Sheng" sort="Tian, Sheng" uniqKey="Tian S" first="Sheng" last="Tian">Sheng Tian</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: stian@suda.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author><author><name sortKey="Ye, Yonghao" sort="Ye, Yonghao" uniqKey="Ye Y" first="Yonghao" last="Ye">Yonghao Ye</name><affiliation wicri:level="1"><nlm:affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China. Electronic address: yeyh@njau.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095</wicri:regionArea><wicri:noRegion>Nanjing 210095</wicri:noRegion></affiliation></author><author><name sortKey="Qiao, Chunhua" sort="Qiao, Chunhua" uniqKey="Qiao C" first="Chunhua" last="Qiao">Chunhua Qiao</name><affiliation wicri:level="1"><nlm:affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: qiaochunhua@suda.edu.cn.</nlm:affiliation><country xml:lang="fr">République populaire de Chine</country><wicri:regionArea>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123</wicri:regionArea><wicri:noRegion>Suzhou 215123</wicri:noRegion></affiliation></author></analytic><series><title level="j">Bioorganic & medicinal chemistry</title><idno type="eISSN">1464-3391</idno><imprint><date when="2018" type="published">2018</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass><keywords scheme="KwdEn" xml:lang="en"><term>Antifungal Agents (chemical synthesis)</term><term>Antifungal Agents (chemistry)</term><term>Antifungal Agents (pharmacology)</term><term>Binding Sites (MeSH)</term><term>Drug Design (MeSH)</term><term>Electron Transport Complex III (chemistry)</term><term>Electron Transport Complex III (metabolism)</term><term>Fungi (drug effects)</term><term>Fusarium (drug effects)</term><term>Microbial Sensitivity Tests (MeSH)</term><term>Molecular Docking Simulation (MeSH)</term><term>Protein Structure, Tertiary (MeSH)</term><term>Strobilurins (chemical synthesis)</term><term>Strobilurins (chemistry)</term><term>Strobilurins (pharmacology)</term><term>Structure-Activity Relationship (MeSH)</term><term>Thermodynamics (MeSH)</term></keywords><keywords scheme="KwdFr" xml:lang="fr"><term>Antifongiques (composition chimique)</term><term>Antifongiques (pharmacologie)</term><term>Antifongiques (synthèse chimique)</term><term>Champignons (effets des médicaments et des substances chimiques)</term><term>Complexe III de la chaîne respiratoire (composition chimique)</term><term>Complexe III de la chaîne respiratoire (métabolisme)</term><term>Conception de médicament (MeSH)</term><term>Fusarium (effets des médicaments et des substances chimiques)</term><term>Relation structure-activité (MeSH)</term><term>Simulation de docking moléculaire (MeSH)</term><term>Sites de fixation (MeSH)</term><term>Strobilurines (composition chimique)</term><term>Strobilurines (pharmacologie)</term><term>Strobilurines (synthèse chimique)</term><term>Structure tertiaire des protéines (MeSH)</term><term>Tests de sensibilité microbienne (MeSH)</term><term>Thermodynamique (MeSH)</term></keywords><keywords scheme="MESH" type="chemical" qualifier="chemical synthesis" xml:lang="en"><term>Antifungal Agents</term><term>Strobilurins</term></keywords><keywords scheme="MESH" type="chemical" qualifier="chemistry" xml:lang="en"><term>Antifungal Agents</term><term>Electron Transport Complex III</term><term>Strobilurins</term></keywords><keywords scheme="MESH" type="chemical" qualifier="metabolism" xml:lang="en"><term>Electron Transport Complex III</term></keywords><keywords scheme="MESH" type="chemical" qualifier="pharmacology" xml:lang="en"><term>Antifungal Agents</term><term>Strobilurins</term></keywords><keywords scheme="MESH" qualifier="composition chimique" xml:lang="fr"><term>Antifongiques</term><term>Complexe III de la chaîne respiratoire</term><term>Strobilurines</term></keywords><keywords scheme="MESH" qualifier="drug effects" xml:lang="en"><term>Fungi</term><term>Fusarium</term></keywords><keywords scheme="MESH" qualifier="effets des médicaments et des substances chimiques" xml:lang="fr"><term>Champignons</term><term>Fusarium</term></keywords><keywords scheme="MESH" qualifier="métabolisme" xml:lang="fr"><term>Complexe III de la chaîne respiratoire</term></keywords><keywords scheme="MESH" qualifier="pharmacologie" xml:lang="fr"><term>Antifongiques</term><term>Strobilurines</term></keywords><keywords scheme="MESH" qualifier="synthèse chimique" xml:lang="fr"><term>Antifongiques</term><term>Strobilurines</term></keywords><keywords scheme="MESH" xml:lang="en"><term>Binding Sites</term><term>Drug Design</term><term>Microbial Sensitivity Tests</term><term>Molecular Docking Simulation</term><term>Protein Structure, Tertiary</term><term>Structure-Activity Relationship</term><term>Thermodynamics</term></keywords><keywords scheme="MESH" xml:lang="fr"><term>Conception de médicament</term><term>Relation structure-activité</term><term>Simulation de docking moléculaire</term><term>Sites de fixation</term><term>Structure tertiaire des protéines</term><term>Tests de sensibilité microbienne</term><term>Thermodynamique</term></keywords></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">A series of novel pyraclostrobin derivatives were designed and prepared as antifungal agents. Their antifungal activities were tested in vitro with five important phytopathogenic fungi, namely, Batrylis cinerea, Phytophthora capsici, Fusarium sulphureum, Gloeosporium pestis and Sclerotinia sclerotiorum using the mycelium growth inhibition method. Among these compounds, 5s displayed IC<sub>50</sub> value of 0.57 μg/mL against Batrylis cinerea and 5k-II displayed IC<sub>50</sub> value of 0.43 μg/mL against Sclerotinia sclerotiorum, which were close to that of the positive control pyraclostrobin (0.18 μg/mL and 0.15 μg/mL). Other compounds 5f, 5k-II, 5j, 5m and 5s also exhibited strong antifungal activity. Further enzymatic assay demonstrated compound 5s inhibited porcine bc<sub>1</sub> complex with IC<sub>50</sub> value of 0.95 μM. The statistical results from an integrated computational pipeline demonstrated the predicted total binding free energy for compound 5s is the highest. Consequently, compound 5s with the biphenyl-4-methoxyl side chain could serve as a new motif as inhibitors of bc<sub>1</sub> complex and deserve to be further investigated.</div></front></TEI><pubmed><MedlineCitation Status="MEDLINE" Owner="NLM"><PMID Version="1">29395803</PMID><DateCompleted><Year>2018</Year><Month>09</Month><Day>07</Day></DateCompleted><DateRevised><Year>2019</Year><Month>12</Month><Day>10</Day></DateRevised><Article PubModel="Print-Electronic"><Journal><ISSN IssnType="Electronic">1464-3391</ISSN><JournalIssue CitedMedium="Internet"><Volume>26</Volume><Issue>4</Issue><PubDate><Year>2018</Year><Month>02</Month><Day>15</Day></PubDate></JournalIssue><Title>Bioorganic & medicinal chemistry</Title><ISOAbbreviation>Bioorg Med Chem</ISOAbbreviation></Journal><ArticleTitle>Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.</ArticleTitle><Pagination><MedlinePgn>875-883</MedlinePgn></Pagination><ELocationID EIdType="pii" ValidYN="Y">S0968-0896(17)32279-4</ELocationID><ELocationID EIdType="doi" ValidYN="Y">10.1016/j.bmc.2018.01.004</ELocationID><Abstract><AbstractText>A series of novel pyraclostrobin derivatives were designed and prepared as antifungal agents. Their antifungal activities were tested in vitro with five important phytopathogenic fungi, namely, Batrylis cinerea, Phytophthora capsici, Fusarium sulphureum, Gloeosporium pestis and Sclerotinia sclerotiorum using the mycelium growth inhibition method. Among these compounds, 5s displayed IC<sub>50</sub> value of 0.57 μg/mL against Batrylis cinerea and 5k-II displayed IC<sub>50</sub> value of 0.43 μg/mL against Sclerotinia sclerotiorum, which were close to that of the positive control pyraclostrobin (0.18 μg/mL and 0.15 μg/mL). Other compounds 5f, 5k-II, 5j, 5m and 5s also exhibited strong antifungal activity. Further enzymatic assay demonstrated compound 5s inhibited porcine bc<sub>1</sub> complex with IC<sub>50</sub> value of 0.95 μM. The statistical results from an integrated computational pipeline demonstrated the predicted total binding free energy for compound 5s is the highest. Consequently, compound 5s with the biphenyl-4-methoxyl side chain could serve as a new motif as inhibitors of bc<sub>1</sub> complex and deserve to be further investigated.</AbstractText><CopyrightInformation>Copyright © 2018 Elsevier Ltd. All rights reserved.</CopyrightInformation></Abstract><AuthorList CompleteYN="Y"><Author ValidYN="Y"><LastName>Wang</LastName><ForeName>Lili</ForeName><Initials>L</Initials><AffiliationInfo><Affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Zhao</LastName><ForeName>Shuangshuang</ForeName><Initials>S</Initials><AffiliationInfo><Affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Kong</LastName><ForeName>Xiaotian</ForeName><Initials>X</Initials><AffiliationInfo><Affiliation>Institute of Functional Nano and Soft Materials (FUNSOM), Soochow University, Suzhou, Jiangsu 215123, PR China.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Cao</LastName><ForeName>Lingling</ForeName><Initials>L</Initials><AffiliationInfo><Affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Tian</LastName><ForeName>Sheng</ForeName><Initials>S</Initials><AffiliationInfo><Affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: stian@suda.edu.cn.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Ye</LastName><ForeName>Yonghao</ForeName><Initials>Y</Initials><AffiliationInfo><Affiliation>College of Plant Protection, State & Local Joint Engineering Research Center of Green Pesticide Invention and Application, Nanjing Agricultural University, Nanjing 210095, PR China. Electronic address: yeyh@njau.edu.cn.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Qiao</LastName><ForeName>Chunhua</ForeName><Initials>C</Initials><AffiliationInfo><Affiliation>Jiangsu Key Laboratory of Preventive and Translational Medicine for Geriatric Diseases, College of Pharmaceutical Sciences, Soochow University, Suzhou 215123, PR China. Electronic address: qiaochunhua@suda.edu.cn.</Affiliation></AffiliationInfo></Author></AuthorList><Language>eng</Language><PublicationTypeList><PublicationType UI="D016428">Journal Article</PublicationType><PublicationType UI="D013485">Research Support, Non-U.S. Gov't</PublicationType></PublicationTypeList><ArticleDate DateType="Electronic"><Year>2018</Year><Month>01</Month><Day>10</Day></ArticleDate></Article><MedlineJournalInfo><Country>England</Country><MedlineTA>Bioorg Med Chem</MedlineTA><NlmUniqueID>9413298</NlmUniqueID><ISSNLinking>0968-0896</ISSNLinking></MedlineJournalInfo><ChemicalList><Chemical><RegistryNumber>0</RegistryNumber><NameOfSubstance UI="D000935">Antifungal Agents</NameOfSubstance></Chemical><Chemical><RegistryNumber>0</RegistryNumber><NameOfSubstance UI="D000073739">Strobilurins</NameOfSubstance></Chemical><Chemical><RegistryNumber>DJW8M9OX1H</RegistryNumber><NameOfSubstance UI="C513428">pyrachlostrobin</NameOfSubstance></Chemical><Chemical><RegistryNumber>EC 7.1.1.8</RegistryNumber><NameOfSubstance UI="D014450">Electron Transport Complex III</NameOfSubstance></Chemical></ChemicalList><CitationSubset>IM</CitationSubset><MeshHeadingList><MeshHeading><DescriptorName UI="D000935" MajorTopicYN="N">Antifungal Agents</DescriptorName><QualifierName UI="Q000138" MajorTopicYN="Y">chemical synthesis</QualifierName><QualifierName UI="Q000737" MajorTopicYN="N">chemistry</QualifierName><QualifierName UI="Q000494" MajorTopicYN="N">pharmacology</QualifierName></MeshHeading><MeshHeading><DescriptorName UI="D001665" MajorTopicYN="N">Binding Sites</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D015195" MajorTopicYN="Y">Drug Design</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D014450" MajorTopicYN="N">Electron Transport Complex III</DescriptorName><QualifierName UI="Q000737" MajorTopicYN="N">chemistry</QualifierName><QualifierName UI="Q000378" MajorTopicYN="N">metabolism</QualifierName></MeshHeading><MeshHeading><DescriptorName UI="D005658" MajorTopicYN="N">Fungi</DescriptorName><QualifierName UI="Q000187" MajorTopicYN="N">drug effects</QualifierName></MeshHeading><MeshHeading><DescriptorName UI="D005670" MajorTopicYN="N">Fusarium</DescriptorName><QualifierName UI="Q000187" MajorTopicYN="N">drug effects</QualifierName></MeshHeading><MeshHeading><DescriptorName UI="D008826" MajorTopicYN="N">Microbial Sensitivity Tests</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D062105" MajorTopicYN="N">Molecular Docking Simulation</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D017434" MajorTopicYN="N">Protein Structure, Tertiary</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D000073739" MajorTopicYN="N">Strobilurins</DescriptorName><QualifierName UI="Q000138" MajorTopicYN="N">chemical synthesis</QualifierName><QualifierName UI="Q000737" MajorTopicYN="Y">chemistry</QualifierName><QualifierName UI="Q000494" MajorTopicYN="N">pharmacology</QualifierName></MeshHeading><MeshHeading><DescriptorName UI="D013329" MajorTopicYN="N">Structure-Activity Relationship</DescriptorName></MeshHeading><MeshHeading><DescriptorName UI="D013816" MajorTopicYN="N">Thermodynamics</DescriptorName></MeshHeading></MeshHeadingList><KeywordList Owner="NOTNLM"><Keyword MajorTopicYN="Y">Antifungal activity</Keyword><Keyword MajorTopicYN="Y">Cytochrome bc(1) complex inhibitor</Keyword><Keyword MajorTopicYN="Y">Molecular docking</Keyword><Keyword MajorTopicYN="Y">Phytopathogenic fungi</Keyword><Keyword MajorTopicYN="Y">Pyraclostrobin analogues</Keyword></KeywordList></MedlineCitation><PubmedData><History><PubMedPubDate PubStatus="received"><Year>2017</Year><Month>11</Month><Day>22</Day></PubMedPubDate><PubMedPubDate PubStatus="revised"><Year>2018</Year><Month>01</Month><Day>05</Day></PubMedPubDate><PubMedPubDate PubStatus="accepted"><Year>2018</Year><Month>01</Month><Day>08</Day></PubMedPubDate><PubMedPubDate PubStatus="pubmed"><Year>2018</Year><Month>2</Month><Day>6</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="medline"><Year>2018</Year><Month>9</Month><Day>8</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="entrez"><Year>2018</Year><Month>2</Month><Day>4</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate></History><PublicationStatus>ppublish</PublicationStatus><ArticleIdList><ArticleId IdType="pubmed">29395803</ArticleId><ArticleId IdType="pii">S0968-0896(17)32279-4</ArticleId><ArticleId IdType="doi">10.1016/j.bmc.2018.01.004</ArticleId></ArticleIdList></PubmedData></pubmed><affiliations><list><country><li>République populaire de Chine</li></country></list><tree><country name="République populaire de Chine"><noRegion><name sortKey="Wang, Lili" sort="Wang, Lili" uniqKey="Wang L" first="Lili" last="Wang">Lili Wang</name></noRegion><name sortKey="Cao, Lingling" sort="Cao, Lingling" uniqKey="Cao L" first="Lingling" last="Cao">Lingling Cao</name><name sortKey="Kong, Xiaotian" sort="Kong, Xiaotian" uniqKey="Kong X" first="Xiaotian" last="Kong">Xiaotian Kong</name><name sortKey="Qiao, Chunhua" sort="Qiao, Chunhua" uniqKey="Qiao C" first="Chunhua" last="Qiao">Chunhua Qiao</name><name sortKey="Tian, Sheng" sort="Tian, Sheng" uniqKey="Tian S" first="Sheng" last="Tian">Sheng Tian</name><name sortKey="Ye, Yonghao" sort="Ye, Yonghao" uniqKey="Ye Y" first="Yonghao" last="Ye">Yonghao Ye</name><name sortKey="Zhao, Shuangshuang" sort="Zhao, Shuangshuang" uniqKey="Zhao S" first="Shuangshuang" last="Zhao">Shuangshuang Zhao</name></country></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
EXPLOR_STEP=$WICRI_ROOT/Bois/explor/PhytophthoraV1/Data/Main/Exploration
HfdSelect -h $EXPLOR_STEP/biblio.hfd -nk 000804 | SxmlIndent | more
Ou
HfdSelect -h $EXPLOR_AREA/Data/Main/Exploration/biblio.hfd -nk 000804 | SxmlIndent | more
Pour mettre un lien sur cette page dans le réseau Wicri
{{Explor lien
|wiki= Bois
|area= PhytophthoraV1
|flux= Main
|étape= Exploration
|type= RBID
|clé= pubmed:29395803
|texte= Design, synthesis and fungicidal evaluation of novel pyraclostrobin analogues.
}}
Pour générer des pages wiki
HfdIndexSelect -h $EXPLOR_AREA/Data/Main/Exploration/RBID.i -Sk "pubmed:29395803" \
| HfdSelect -Kh $EXPLOR_AREA/Data/Main/Exploration/biblio.hfd \
| NlmPubMed2Wicri -a PhytophthoraV1
| This area was generated with Dilib version V0.6.38. |  |