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  • Interactions of natural products, their derivatives and coordination compounds with proteins and nucleic acids

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  • image/svg+xml art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos Open Access logo, converted into svg, designed by PLoS. This version with transparent background. http://commons.wikimedia.org/wiki/File:Open_Access_logo_PLoS_white.svg art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos http://www.plos.org/
    Authors: Darmanović, Darinka; Shcherbakov, Igor N.; Duboc, Carole; Spasojević, Vojislav; +8 Authors

    Comparison of the EPR spectra of 1 and 2 (Figure S1); additional Mössbauer spectra (Figures S2–S5); Kohn–Sham molecular orbitals with dominant metal d character (Figures S6–S8); calculated principal components of the g-tensor (Table S1); calculated J values (Table S2); transition energies and contributions of the excited states to D and E (Tables S3–S6); d-orbital splitting according to AI-LFT (Table S7); composition of the multideterminant wave function of the ground and selected excited states (Table S8). This is Supplementary information for: Darmanović Darinka, Shcherbakov Igor N., Duboc Carole, Spasojević Vojislav, Hanžel Darko, Anđelković Katarina, Radanović Dušanka, Turel Iztok, Milenković Milica R., Gruden Maja, Čobeljić Božidar, Zlatar Matija, "Combined Experimental and Theoretical Investigation of the Origin of Magnetic Anisotropy in Pentagonal Bipyramidal Isothiocyanato Co(II), Ni(II), and Fe(III) Complexes with Quaternary-Ammonium-Functionalized 2,6-Diacetylpyridine Bisacylhydrazone" 123, no. 51 (2019):31142-31155, [https://dx.doi.org/ 10.1021/acs.jpcc.9b08066 ] The published version of the article: [http://cer.ihtm.bg.ac.rs/handle/123456789/3314] The peer-reviewed version of the article: [http://cer.ihtm.bg.ac.rs/handle/123456789/3269]

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    Authors: Jeremić, Marko; Pešić, Milica; Dinić, Jelena; Bankovic, Jasna; +3 Authors

    In this work, synthesis of alkylamino and aralkylamino derivatives of sesquiterpene quinone avarone and its model compound tert-butylquinone was described. For all obtained derivatives biological activity was studied. Cytotoxic activity of the synthesized derivatives towards multidrug resistant MDR human non small cell lung carcinoma NCI-H460/R cells, their sensitive counterpart NCI-H460 and human normal keratinocytes (HaCaT) as well as detection of cell death superoxide anion generation were investigated. Antimicrobial activity towards Gram positive and Gram negative bacteria and fungal cultures was determined. The results showed that strong cytotoxic activity toward cancer cells was improved with simple avarone mimetics. Some derivatives were selective towards MDR cancer cells. The most active derivatives induced apoptosis in both cancer cell lines, but not in normal cells. Superoxide production was induced by 2,6-disubstituted compounds in MDR cancer cells and not by less active 2,5-disubstituted compounds and was accompanied by the collapse of the mitochondrial transmembrane potential. Two tert-butylquinone derivatives were particularly selective towards MDR cancer cells. Some tert-butylquinone derivatives exhibited a strong antimicrobial activity. The supplementary material for: Jeremić, M., Pešić, M., Dinić, J., Bankovic, J., Novaković, I., Šegan, D.,& Sladić, D. (2016). Simple avarone mimetics as selective agents against multidrug resistant cancer cells. European Journal of Medicinal Chemistry, 118, 107-120. [https://doi.org/10.1016/j.ejmech.2016.04.011] Published version of the aticle: [https://cer.ihtm.bg.ac.rs/handle/123456789/1862] The peer-reviewed version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/4579]

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    Authors: Pevec, Andrej;

    HIYYAS : chloro-[2-(oxy)-N,N,N-trimethyl-2-{[1-(pyridin-2-yl)ethylidene]hydrazinylidene}ethan-1-aminiumato]-perchlorato-copper(ii) Space Group: P 21/c (14), Cell: a 9.9406(2)Å b 9.5650(2)Å c 18.8796(5)Å, α 90° β 94.7120(10)° γ 90° Crystallographic data (CCDC 1886534) for the article: Milenković, M. R., Papastavrou, A. T., Radanović, D., Pevec, A., Jagličić, Z., Zlatar, M., Gruden, M., Vougioukalakis, G. C., Turel, I., Anđelković, K.,& Čobeljić, B. (2019). Highly-efficient N-arylation of imidazole catalyzed by Cu(II) complexes with quaternary ammonium-functionalized 2-acetylpyridine acylhydrazone. Polyhedron, Elsevier., 165, 22-30. [https://doi.org/10.1016/j.poly.2019.03.001] Published version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/2634] Peer-reviewed manuscript: [http://cer.ihtm.bg.ac.rs/handle/123456789/2632] Supporting information: [https://cer.ihtm.bg.ac.rs/handle/123456789/4472] Related crystallographic data (CCDC 1886535): [https://cer.ihtm.bg.ac.rs/handle/123456789/4474]

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    Authors: Vilipić, Jovana; Novaković, Irena T.; Zlatović, Mario; Vujčić, Miroslava; +2 Authors

    Supplementary material for: [https://doi.org/10.2298/JSC160725101V] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/2389]

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    Authors: Čobeljić, Božidar; Pevec, Andrej; Jagličić, Zvonko; Milenković, Milica R.; +4 Authors

    Supplementary material for: [https://doi.org/10.2298/JSC180828079C] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/2810]

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    Authors: Vilipić, Jovana; Novaković, Irena T.; Stanojković, Tatjana; Matić, Ivana Z.; +3 Authors

    Supplementary material for: [https://doi.org/10.1016/j.bmc.2015.09.044] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1997] Related to accepted version: [http://cherry.chem.bg.ac.rs/handle/123456789/3438]

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    Authors: Božić, Aleksandra R.; Bjelogrlić, Snežana K.; Novaković, Irena; Filipovic, Nenad R.; +4 Authors

    Table S1. Statistics of the PCA model generated after 2 FFD cycle. Table S2. Statistics of 3LV PLS model applying different CV procedures. Table S3. Statistics of the PCA model generated after 2 FFD cycle. Table S4. Statistics of 2LV PLS model applying different CV procedures. Experimental Section: materials, methods, general procedure for synthesis of m-TCHs 1-11, general procedure for synthesis of b-TCHs 12-22,. Antimicrobial activity: agar diffusion method, Broth microdilution antimicrobial assay. Alignment-independent 3D QSAR models. Figure S1. 1H NMR spectrum of 3 in DMSO-d6. Figure S2.13C NMR spectrum of 3 in DMSO-d6. Figure S3. 1H NMR spectrum of 4 in DMSO-d6. Figure S4.13C NMR spectrum of 4 in DMSO-d6. Figure S5. 1H NMR spectrum of 6 in DMSO-d6. Figure S6.13C NMR spectrum of 6 in DMSO-d6. Additional references. The supporting information for: Božić, A. R., Bjelogrlić, S. K., Novaković, I., Filipovic, N. R., Petrović, P. M., Marinković, A. D., Todorović, T.,& Cvijetić, I. (2018). Antimicrobial Activity of Thiocarbohydrazones: Experimental Studies and Alignment-Independent 3D QSAR Models. Chemistryselect, Wiley, 3(7), 2215-2221. [https://doi.org/10.1002/slct.201702691] The published version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/2329]

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    Authors: Filipović, Nenad R.; Bjelogrlić, Snežana K.; Pelliccia, Sveva; Jovanović, Vesna B.; +6 Authors

    Supplementary material for: [https://doi.org/10.1016/j.arabjc.2017.11.017] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/320]

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    Authors: Filipović, Nenad R.; Borna, Marija; Klisurić, Olivera; Pregelj, Matej; +3 Authors

    Supplementary material for: [https://doi.org/10.1080/00958972.2013.786052] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1639]

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    Authors: Pevec, Andrej;

    HIYYEW : bis(μ-azido)-bis[2-(oxy)-N,N,N-trimethyl-2-{[1-(pyridin-2-yl)ethylidene]hydrazinylidene}ethan-1-aminiumato]-di-copper(ii) bis(perchlorate) Space Group: C 2/c (15), Cell: a 16.4095(6)Å b 13.6320(6)Å c 17.1507(8)Å, α 90° β 108.145(5)° γ 90° Crystallographic data (CCDC 1886535) for the article: Milenković, M. R., Papastavrou, A. T., Radanović, D., Pevec, A., Jagličić, Z., Zlatar, M., Gruden, M., Vougioukalakis, G. C., Turel, I., Anđelković, K.,& Čobeljić, B. (2019). Highly-efficient N-arylation of imidazole catalyzed by Cu(II) complexes with quaternary ammonium-functionalized 2-acetylpyridine acylhydrazone. Polyhedron, Elsevier., 165, 22-30. [https://doi.org/10.1016/j.poly.2019.03.001] Published version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/2634] Peer-reviewed manuscript: [http://cer.ihtm.bg.ac.rs/handle/123456789/2632] Supporting information: [https://cer.ihtm.bg.ac.rs/handle/123456789/4472] Related crystallographic data (CCDC 1886534): [https://cer.ihtm.bg.ac.rs/handle/123456789/4473]

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  • image/svg+xml art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos Open Access logo, converted into svg, designed by PLoS. This version with transparent background. http://commons.wikimedia.org/wiki/File:Open_Access_logo_PLoS_white.svg art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos http://www.plos.org/
    Authors: Darmanović, Darinka; Shcherbakov, Igor N.; Duboc, Carole; Spasojević, Vojislav; +8 Authors

    Comparison of the EPR spectra of 1 and 2 (Figure S1); additional Mössbauer spectra (Figures S2–S5); Kohn–Sham molecular orbitals with dominant metal d character (Figures S6–S8); calculated principal components of the g-tensor (Table S1); calculated J values (Table S2); transition energies and contributions of the excited states to D and E (Tables S3–S6); d-orbital splitting according to AI-LFT (Table S7); composition of the multideterminant wave function of the ground and selected excited states (Table S8). This is Supplementary information for: Darmanović Darinka, Shcherbakov Igor N., Duboc Carole, Spasojević Vojislav, Hanžel Darko, Anđelković Katarina, Radanović Dušanka, Turel Iztok, Milenković Milica R., Gruden Maja, Čobeljić Božidar, Zlatar Matija, "Combined Experimental and Theoretical Investigation of the Origin of Magnetic Anisotropy in Pentagonal Bipyramidal Isothiocyanato Co(II), Ni(II), and Fe(III) Complexes with Quaternary-Ammonium-Functionalized 2,6-Diacetylpyridine Bisacylhydrazone" 123, no. 51 (2019):31142-31155, [https://dx.doi.org/ 10.1021/acs.jpcc.9b08066 ] The published version of the article: [http://cer.ihtm.bg.ac.rs/handle/123456789/3314] The peer-reviewed version of the article: [http://cer.ihtm.bg.ac.rs/handle/123456789/3269]

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    Authors: Jeremić, Marko; Pešić, Milica; Dinić, Jelena; Bankovic, Jasna; +3 Authors

    In this work, synthesis of alkylamino and aralkylamino derivatives of sesquiterpene quinone avarone and its model compound tert-butylquinone was described. For all obtained derivatives biological activity was studied. Cytotoxic activity of the synthesized derivatives towards multidrug resistant MDR human non small cell lung carcinoma NCI-H460/R cells, their sensitive counterpart NCI-H460 and human normal keratinocytes (HaCaT) as well as detection of cell death superoxide anion generation were investigated. Antimicrobial activity towards Gram positive and Gram negative bacteria and fungal cultures was determined. The results showed that strong cytotoxic activity toward cancer cells was improved with simple avarone mimetics. Some derivatives were selective towards MDR cancer cells. The most active derivatives induced apoptosis in both cancer cell lines, but not in normal cells. Superoxide production was induced by 2,6-disubstituted compounds in MDR cancer cells and not by less active 2,5-disubstituted compounds and was accompanied by the collapse of the mitochondrial transmembrane potential. Two tert-butylquinone derivatives were particularly selective towards MDR cancer cells. Some tert-butylquinone derivatives exhibited a strong antimicrobial activity. The supplementary material for: Jeremić, M., Pešić, M., Dinić, J., Bankovic, J., Novaković, I., Šegan, D.,& Sladić, D. (2016). Simple avarone mimetics as selective agents against multidrug resistant cancer cells. European Journal of Medicinal Chemistry, 118, 107-120. [https://doi.org/10.1016/j.ejmech.2016.04.011] Published version of the aticle: [https://cer.ihtm.bg.ac.rs/handle/123456789/1862] The peer-reviewed version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/4579]

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    Authors: Pevec, Andrej;

    HIYYAS : chloro-[2-(oxy)-N,N,N-trimethyl-2-{[1-(pyridin-2-yl)ethylidene]hydrazinylidene}ethan-1-aminiumato]-perchlorato-copper(ii) Space Group: P 21/c (14), Cell: a 9.9406(2)Å b 9.5650(2)Å c 18.8796(5)Å, α 90° β 94.7120(10)° γ 90° Crystallographic data (CCDC 1886534) for the article: Milenković, M. R., Papastavrou, A. T., Radanović, D., Pevec, A., Jagličić, Z., Zlatar, M., Gruden, M., Vougioukalakis, G. C., Turel, I., Anđelković, K.,& Čobeljić, B. (2019). Highly-efficient N-arylation of imidazole catalyzed by Cu(II) complexes with quaternary ammonium-functionalized 2-acetylpyridine acylhydrazone. Polyhedron, Elsevier., 165, 22-30. [https://doi.org/10.1016/j.poly.2019.03.001] Published version of the article: [https://cer.ihtm.bg.ac.rs/handle/123456789/2634] Peer-reviewed manuscript: [http://cer.ihtm.bg.ac.rs/handle/123456789/2632] Supporting information: [https://cer.ihtm.bg.ac.rs/handle/123456789/4472] Related crystallographic data (CCDC 1886535): [https://cer.ihtm.bg.ac.rs/handle/123456789/4474]

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    Authors: Vilipić, Jovana; Novaković, Irena T.; Zlatović, Mario; Vujčić, Miroslava; +2 Authors

    Supplementary material for: [https://doi.org/10.2298/JSC160725101V] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/2389]

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    Authors: Čobeljić, Božidar; Pevec, Andrej; Jagličić, Zvonko; Milenković, Milica R.; +4 Authors

    Supplementary material for: [https://doi.org/10.2298/JSC180828079C] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/2810]

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    Authors: Vilipić, Jovana; Novaković, Irena T.; Stanojković, Tatjana; Matić, Ivana Z.; +3 Authors

    Supplementary material for: [https://doi.org/10.1016/j.bmc.2015.09.044] Related to published version: [http://cherry.chem.bg.ac.rs/handle/123456789/1997] Related to accepted version: [http://cherry.chem.bg.ac.rs/handle/123456789/3438]

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