Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses

Detalhes bibliográficos
Autor(a) principal: Valner Augusto Freitas da Silva da Nova Mussel
Data de Publicação: 2018
Outros Autores: Max Passos Ferreira, Maria Betânia de Freitas Marques, Maria Irene Yoshida, Mariana Ramos Almeida, Bernardo Lages Rodrigues, Wagner da Nova Mussel
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Institucional da UFMG
Texto Completo: http://hdl.handle.net/1843/40909
Resumo: CNPq - Conselho Nacional de Desenvolvimento Científico e Tecnológico
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spelling 2022-04-07T23:39:24Z2022-04-07T23:39:24Z2018-068319420110.1016/j.jpha.2018.01.0052095-1779http://hdl.handle.net/1843/40909CNPq - Conselho Nacional de Desenvolvimento Científico e TecnológicoFAPEMIG - Fundação de Amparo à Pesquisa do Estado de Minas GeraisCAPES - Coordenação de Aperfeiçoamento de Pessoal de Nível SuperiorThalidomide was indicated as a sedative and antiemetic and prescribed for pregnant women. Its tragic teratogenic effects culminated in withdrawal from the market. Since the discovery of its anti-angiogenic and anti-inflammatory actions, thalidomide has been used in the treatment of leprosy and multiple myeloma, which justify studies of its stability. We investigated the effects of irradiation of thalidomide up to 100 kGy (fourfold the usual sterilizing dose for pharmaceutics). The β polymorph of thalidomide was obtained in an isothermal experiment at 270 °C. All samples underwent gamma irradiation for specific times. At different doses, decomposition of the pharmaceutical was not observed up to 100 kGy. The observed effect was angle turning between the phthalimide and glutarimide rings modulated by repulsion towards the carbonyl group, leading to a stable energetic configuration, as measured by the equilibrium in the torsion angle after irradiation. The thalidomide molecule has a center of symmetry, so a full turn starting from 57.3° will lead to an identical molecule. Further irradiation will start the process again. Samples irradiated at 30 and 100 kGy have more compact unit cells and a lower volume, which leads to an increase in the intermolecular hydrogen interaction within the unit cell, resulting in higher thermal stability for polymorph α.engUniversidade Federal de Minas GeraisUFMGBrasilFAR - DEPARTAMENTO DE ALIMENTOSICX - DEPARTAMENTO DE QUÍMICAJournal of Pharmaceutical AnalysisTalidomidaRadiação gamaDoses de esterilizaçãoSuperfície de HirshfeldThalidomideThermal stabilityPolymorphsGamma irradiationHirshfeldPhysics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization dosesinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articlehttps://www.sciencedirect.com/science/article/pii/S2095177918300054?via%3DihubValner Augusto Freitas da Silva da Nova MusselMax Passos FerreiraMaria Betânia de Freitas MarquesMaria Irene YoshidaMariana Ramos AlmeidaBernardo Lages RodriguesWagner da Nova Musselapplication/pdfinfo:eu-repo/semantics/openAccessreponame:Repositório Institucional da UFMGinstname:Universidade Federal de Minas Gerais (UFMG)instacron:UFMGLICENSELicense.txtLicense.txttext/plain; charset=utf-82042https://repositorio.ufmg.br/bitstream/1843/40909/1/License.txtfa505098d172de0bc8864fc1287ffe22MD51ORIGINALPhysics, chemistry, and Hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses.pdfPhysics, chemistry, and Hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses.pdfapplication/pdf2707030https://repositorio.ufmg.br/bitstream/1843/40909/2/Physics%2c%20chemistry%2c%20and%20Hirshfeld%20surface%20analyses%20of%20gamma-irradiated%20thalidomide%20to%20evaluate%20behavior%20under%20sterilization%20doses.pdf1c6d2e1bae3a0d8cc001957a34ce8cdbMD521843/409092022-04-07 20:39:25.163oai:repositorio.ufmg.br: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Repositório de PublicaçõesPUBhttps://repositorio.ufmg.br/oaiopendoar:2022-04-07T23:39:25Repositório Institucional da UFMG - Universidade Federal de Minas Gerais (UFMG)false
dc.title.pt_BR.fl_str_mv Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
title Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
spellingShingle Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
Valner Augusto Freitas da Silva da Nova Mussel
Thalidomide
Thermal stability
Polymorphs
Gamma irradiation
Hirshfeld
Talidomida
Radiação gama
Doses de esterilização
Superfície de Hirshfeld
title_short Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
title_full Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
title_fullStr Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
title_full_unstemmed Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
title_sort Physics, chemistry, and hirshfeld surface analyses of gamma-irradiated thalidomide to evaluate behavior under sterilization doses
author Valner Augusto Freitas da Silva da Nova Mussel
author_facet Valner Augusto Freitas da Silva da Nova Mussel
Max Passos Ferreira
Maria Betânia de Freitas Marques
Maria Irene Yoshida
Mariana Ramos Almeida
Bernardo Lages Rodrigues
Wagner da Nova Mussel
author_role author
author2 Max Passos Ferreira
Maria Betânia de Freitas Marques
Maria Irene Yoshida
Mariana Ramos Almeida
Bernardo Lages Rodrigues
Wagner da Nova Mussel
author2_role author
author
author
author
author
author
dc.contributor.author.fl_str_mv Valner Augusto Freitas da Silva da Nova Mussel
Max Passos Ferreira
Maria Betânia de Freitas Marques
Maria Irene Yoshida
Mariana Ramos Almeida
Bernardo Lages Rodrigues
Wagner da Nova Mussel
dc.subject.por.fl_str_mv Thalidomide
Thermal stability
Polymorphs
Gamma irradiation
Hirshfeld
topic Thalidomide
Thermal stability
Polymorphs
Gamma irradiation
Hirshfeld
Talidomida
Radiação gama
Doses de esterilização
Superfície de Hirshfeld
dc.subject.other.pt_BR.fl_str_mv Talidomida
Radiação gama
Doses de esterilização
Superfície de Hirshfeld
description CNPq - Conselho Nacional de Desenvolvimento Científico e Tecnológico
publishDate 2018
dc.date.issued.fl_str_mv 2018-06
dc.date.accessioned.fl_str_mv 2022-04-07T23:39:24Z
dc.date.available.fl_str_mv 2022-04-07T23:39:24Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://hdl.handle.net/1843/40909
dc.identifier.doi.pt_BR.fl_str_mv 10.1016/j.jpha.2018.01.005
dc.identifier.issn.pt_BR.fl_str_mv 2095-1779
identifier_str_mv 10.1016/j.jpha.2018.01.005
2095-1779
url http://hdl.handle.net/1843/40909
dc.language.iso.fl_str_mv eng
language eng
dc.relation.ispartof.pt_BR.fl_str_mv Journal of Pharmaceutical Analysis
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Universidade Federal de Minas Gerais
dc.publisher.initials.fl_str_mv UFMG
dc.publisher.country.fl_str_mv Brasil
dc.publisher.department.fl_str_mv FAR - DEPARTAMENTO DE ALIMENTOS
ICX - DEPARTAMENTO DE QUÍMICA
publisher.none.fl_str_mv Universidade Federal de Minas Gerais
dc.source.none.fl_str_mv reponame:Repositório Institucional da UFMG
instname:Universidade Federal de Minas Gerais (UFMG)
instacron:UFMG
instname_str Universidade Federal de Minas Gerais (UFMG)
instacron_str UFMG
institution UFMG
reponame_str Repositório Institucional da UFMG
collection Repositório Institucional da UFMG
bitstream.url.fl_str_mv https://repositorio.ufmg.br/bitstream/1843/40909/1/License.txt
https://repositorio.ufmg.br/bitstream/1843/40909/2/Physics%2c%20chemistry%2c%20and%20Hirshfeld%20surface%20analyses%20of%20gamma-irradiated%20thalidomide%20to%20evaluate%20behavior%20under%20sterilization%20doses.pdf
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