| Author | Menezes, Paula dos Passos | |
| Author | Dória, Grace Anne Azevedo | |
| Author | Araújo, Adriano Antunes de Souza | |
| Author | Sousa, Bruna Maria Hipólito | |
| Author | Quintans Júnior, Lucindo José | |
| Author | Lima, Rafaely Nascimento | |
| Author | Alves, Péricles Barreto | |
| Author | Carvalho, Flávio Machado Souza | |
| Author | Bezerra, Daniel Pereira | |
| Author | Mendonça Júnior, Francisco Jaime Bezerra | |
| Author | Scotti, Luciana | |
| Author | Scotti, Marcus Tullius | |
| Author | Silva, Gabriel Francisco da | |
| Author | Aquino, Thiago Mendonça de | |
| Author | Sabino, Adilson Rodrigues | |
| Author | Egito, Eryvaldo Socrates Tabosa do | |
| Author | Serafini, Mairim Russo | |
| Access date | 2016-08-22T14:10:32Z | |
| Available date | 2016-08-22T14:10:32Z | |
| Document date | 2016 | |
| Citation | MENEZES, P. P. et al. Docking and physico-chemical properties of α- and β-cyclodextrin complex containing isopulegol: a comparative study. Journal of Inclusion Phenomena and Macrocyclic Chemistry, 16 jun. 2016. | pt_BR |
| ISSN | 0923-0750 | pt_BR |
| URI | https://www.arca.fiocruz.br/handle/icict/15317 | |
| Language | eng | pt_BR |
| Publisher | Springer Verlag | pt_BR |
| Rights | open access | pt_BR |
| Title | Docking and physico-chemical properties of α- and β-cyclodextrin complex containing isopulegol: a comparative study | pt_BR |
| Type | Article | pt_BR |
| Abstract | Isopulegol (ISOP) is a monoterpenoid alcohol presented in the essential oils of several plants that possesses therapeutic properties The aim of this work was prepare samples with ISOP and α- and β-cyclodextrins (α- and β-CD) through three different methods: physical mixture, paste method (PC) and slurry complexation (SC). In order to evaluate the formation of inclusion complexes, the techniques of differential scanning calorimetry, thermogravimetry/derivative thermogravimetry, fourier transform infrared spectroscopy, X-ray diffractometry (XRD), gas chromatography–mass spectrometry analyses (GC/MS), docking, nuclear magnetic resonance and scanning electron microscopy were considered. The analyses of the α-CD or β-CD/ISOP revealed the formation of a complex mainly through the PC and SC methods for α-CD and β-CD, respectively. XRD diffraction characteristics presented formation of a trend to new solid phase, which suggested the formation of inclusion complexes. The GC/MS demonstrated that the PC method was the best one to form complexation with α-CD (48.8 %). Concerning β-CD, the SC method exhibited the strongest complexation (68.3 %). Furthermore, the molecular theoretical docking study demonstrated that α-CD/ISOP inclusion complex formed a more stable complex than did the β-CD/ISOP inclusion complex. | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Farmácia. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Farmácia. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Farmácia. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Farmácia. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Fisiologia. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Química. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Química. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Mineralogia e Geotectônica. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Fundação Oswaldo Cruz. Centro de Pesquisas Gonçalo Moniz. Salvador, BA, Brasil | pt_BR |
| Affilliation | Universidade Estadual da Paraíba. Laboratório de Síntese e Vetorização de Moléculas. Campina Grande, PB, Brasil | pt_BR |
| Affilliation | Universidade Federal da Paraíba. Campina Grande, PB, Brasil | pt_BR |
| Affilliation | Universidade Federal da Paraíba. Departamento de Engenharia e Ambiente. Campina Grande, PB, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Engenharia Química. São Cristóvão, SE, Brasil | pt_BR |
| Affilliation | Universidade Federal de Alagoas. Laboratório de Ressonância Magnética Nuclear. Maceió, AL, Brasil | pt_BR |
| Affilliation | Universidade Federal de Alagoas. Laboratório de Ressonância Magnética Nuclear. Maceió, AL, Brasil | pt_BR |
| Affilliation | Universidade Federal do Rio Grande do Norte. Departamento de Farmácia. Natal, RGNorte, Brasil | pt_BR |
| Affilliation | Universidade Federal de Sergipe. Departamento de Farmácia. São Cristóvão, SE, Brasil | pt_BR |
| Subject | Cyclodextrin | pt_BR |
| Subject | Inclusion complexes | pt_BR |
| Subject | Isopulegol | pt_BR |
| Subject | Monoterpenoid | pt_BR |
