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1.
Molecules ; 27(23)2022 Nov 26.
Artigo em Inglês | MEDLINE | ID: mdl-36500338

RESUMO

Plant extracts are increasingly tested for their biological activity and interactions with neoplastic cells. One of such sources of biologically active substances is propolis. This product has been known for thousands of years and is widely used in alternative, folk medicine. Articles describing its effects on the metabolism and cell signaling pathways of neoplastic cells derived from different organs are also published more and more frequently. The purpose of our study was to evaluate the biological activity of propolis extract produced with the cold separation method into hormone-dependent and hormone-independent prostate cancer cell lines. In our study, the propolis extracts showed at least an inhibitory effect on the growth of PC-3 and DU-145 neoplastic cells. Our results suggest that propolis extracts obtained with the cold separation method may be considered as promising compounds for the production of health-promoting supplements.


Assuntos
Própole , Neoplasias da Próstata , Masculino , Humanos , Própole/farmacologia , Proliferação de Células , Extratos Vegetais/farmacologia , Neoplasias da Próstata/tratamento farmacológico , Linhagem Celular , Hormônios/farmacologia
2.
J Chem Phys ; 142(3): 034302, 2015 Jan 21.
Artigo em Inglês | MEDLINE | ID: mdl-25612704

RESUMO

The computational results of the features observed in the room-temperature Q-band absorption spectrum of free-base chlorin (H2Ch) are presented. The vibrational structures of the first and second excited singlet states were calculated based on a harmonic approximation using density functional theory and its time dependent extension within the Franck-Condon and Herzberg-Teller approaches. The outcome allowed to identify the experimental bands and to assign them to the specific vibrational transitions. A very good agreement between the simulated and measured wavelengths and their relative intensities provided the opportunity to predict the origin of the S0 → S2 transition which could not be determined experimentally.

3.
Phys Chem Chem Phys ; 15(45): 19651-8, 2013 Dec 07.
Artigo em Inglês | MEDLINE | ID: mdl-24131960

RESUMO

Porphyrins are compounds which are fundamental for designing many photosensitizers assigned for use in photodynamic therapy (PDT). However, photosensitizers available on the drug market are not ideal for use in PDT among others because of their low absorption in the wavelength range optimal for tissue penetration, i.e. the near-infrared (NIR) spectral region. In the present study the density functional theory and its time dependent extension calculations have been used to design new porphyrin-based photosensitizers with absorption in the therapeutic window of PDT of 700-800 nm. Theoretical investigation of four different derivatives of the 5,10,15,20-tetrakis(4-hydroxyphenyl)porphyrin (p-THPP) revealed specific 'bridge' configurations which have a significant influence on absorption spectra. The results of the present study may be a useful starting point for future design of porphyrin derivatives as improved photosensitizers.


Assuntos
Modelos Moleculares , Fármacos Fotossensibilizantes/química , Porfirinas/química , Absorção , Metilação , Conformação Molecular , Espectrofotometria Infravermelho , Termodinâmica
4.
Plants (Basel) ; 12(4)2023 Feb 16.
Artigo em Inglês | MEDLINE | ID: mdl-36840233

RESUMO

Propolis and its extracts show a wide spectrum of biological activity. Due to the necessity to use high temperatures and high polarity in the eluent, the obtained extracts are depleted of active compounds. The new, cold separation method allows obtaining a qualitatively better product containing a number of chemical compounds absent in extracts obtained using high-temperature methods. The purpose of our study was to evaluate the biological activity of propolis extracts produced with the cold separation method in four female breast cancer cell lines: MDA-MB-231, MDA-MB-468, MCF-7, and T-47D. The results of the breast cancer cell viability were obtained using the MTT test. Propolis extracts at 75 and 80% showed similar cytotoxicity against cancer cells, with the polyphenol fraction 75% being slightly more negative for cells. Propolis extracts at concentrations of 50, 75, and 100 µg/mL significantly reduced cell viability. With the exception of the MDA-MB-231 line, cell viability was also decreased after incubation with a concentration of 25 µg/mL. Our results suggest that propolis extracts obtained with the cold separation method may be considered as promising compounds for the production of health-promoting supplements.

5.
Spectrochim Acta A Mol Biomol Spectrosc ; 58(10): 2127-33, 2002 Aug.
Artigo em Inglês | MEDLINE | ID: mdl-12212737

RESUMO

For quaternary salts of diazaphenanthrenes 1-3 with methyl iodide 4-6, diiodomethane 7-9 and 1,2-dibromoethane 10-12 UV spectral values have been calculated by AM1 CI, and in the case of 4-6 also with ZINDO/S method. Correlations of experimental and calculated wavenumber values of considered compounds show good compatibility. For geometry optimisation of 4-9 the AM1 CI method has been used.


Assuntos
Alcanos/química , Compostos Aza/química , Fenantrenos/química , Sais/química , Ânions/química , Hidrocarbonetos Bromados/química , Indicadores e Reagentes , Conformação Molecular , Estrutura Molecular , Espectrofotometria Ultravioleta/métodos
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