Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental

Detalhes bibliográficos
Ano de defesa: 2023
Autor(a) principal: Mühlen, Lisandro von lattes
Orientador(a): Prestes, Osmar Damian lattes
Banca de defesa: Amaral, Camila Costa de Amorim, Souza, Darliana Mello, Gonçalves, Fábio Ferreira, Becker, Raquel Wielens
Tipo de documento: Tese
Tipo de acesso: Acesso aberto
Idioma: por
Instituição de defesa: Universidade Federal de Santa Maria
Centro de Ciências Naturais e Exatas
Programa de Pós-Graduação: Programa de Pós-Graduação em Química
Departamento: Química
País: Brasil
Palavras-chave em Português:
Palavras-chave em Inglês:
Área do conhecimento CNPq:
Link de acesso: http://repositorio.ufsm.br/handle/1/30518
Resumo: One of the main sources of pollution of aquatic systems by drugs is the incorrect disposal of hospital effluents (HWW). The HWW matrix is quite complex and therefore its analysis is a challenge, in this context, sample preparation plays an important role in the determination of these substances. The combination of DSPE and SPE techniques was evaluated in the preparation stage of HWW samples, from two hospitals (HA and HB) in Porto Alegre (RS, Brazil), and the use of a method of direct injection of samples from a hospital (HC) in Santa Maria (RS, Brazil), for the determination of pharmaceuticals and metabolites and subsequent study of environmental risk. The combined method presented in this study had was successfully employed for the screening and quantification of pharmacological compounds and metabolites present in hospital effluents, with heterogeneous complexity characteristics. The screening method enabled the identification of five metabolites and 45 active principles, from which 24 were classified as suspect and 22 confirmed with standards. The quantification method had a linear response for 35 compounds and it was possible to quantify 22 analytes present in the samples, in a range from 1.17 µg L-1 to 239.64 µg L-1 . Furthermore, the direct injection analysis method presented in this study was successfully employed for the quantification of 35 compounds, of which up to 7 presented values above the LOQ of the method in hospital effluent. The HC samples showed concentrations in a range of 3.02 µg L-1 to 235.18 µg L-1 . There are indications of climatic conditions influence regarding to the concentration of drugs present in the effluent. The environmental risk assessment provided an RQ value > 1 for several compounds quantified in the HA and HB samples, with RQmix in the order of 30x106 for HA and 20x106 for HB. The RQmix for the samples from HC were in the order of 8x104 and 2x105 , respectively on winter and summer. The effluents from the three evaluated hospitals present an environmental risk for aquatic species and small rodents, based on the results of RQ and RQmix, and contribute to the fate and persistence of drugs in the environment.
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spelling 2023-11-16T19:03:57Z2023-11-16T19:03:57Z2023-10-02http://repositorio.ufsm.br/handle/1/30518One of the main sources of pollution of aquatic systems by drugs is the incorrect disposal of hospital effluents (HWW). The HWW matrix is quite complex and therefore its analysis is a challenge, in this context, sample preparation plays an important role in the determination of these substances. The combination of DSPE and SPE techniques was evaluated in the preparation stage of HWW samples, from two hospitals (HA and HB) in Porto Alegre (RS, Brazil), and the use of a method of direct injection of samples from a hospital (HC) in Santa Maria (RS, Brazil), for the determination of pharmaceuticals and metabolites and subsequent study of environmental risk. The combined method presented in this study had was successfully employed for the screening and quantification of pharmacological compounds and metabolites present in hospital effluents, with heterogeneous complexity characteristics. The screening method enabled the identification of five metabolites and 45 active principles, from which 24 were classified as suspect and 22 confirmed with standards. The quantification method had a linear response for 35 compounds and it was possible to quantify 22 analytes present in the samples, in a range from 1.17 µg L-1 to 239.64 µg L-1 . Furthermore, the direct injection analysis method presented in this study was successfully employed for the quantification of 35 compounds, of which up to 7 presented values above the LOQ of the method in hospital effluent. The HC samples showed concentrations in a range of 3.02 µg L-1 to 235.18 µg L-1 . There are indications of climatic conditions influence regarding to the concentration of drugs present in the effluent. The environmental risk assessment provided an RQ value > 1 for several compounds quantified in the HA and HB samples, with RQmix in the order of 30x106 for HA and 20x106 for HB. The RQmix for the samples from HC were in the order of 8x104 and 2x105 , respectively on winter and summer. The effluents from the three evaluated hospitals present an environmental risk for aquatic species and small rodents, based on the results of RQ and RQmix, and contribute to the fate and persistence of drugs in the environment.Uma das principais fontes de poluição dos sistemas aquáticos por fármacos é a disposição incorreta de efluentes hospitalares (HWW). A matriz HWW é bastante complexa e desse modo a sua análise é um desafio e, neste contexto, o preparo de amostra tem um papel importante na determinação destas substâncias. Avaliou-se a combinação das técnicas de DSPE e SPE na etapa de preparo de amostra de HWW, provenientes de dois hospitais (HA e HB) de Porto Alegre (RS, Brasil). Além disso, utilizou-se um método de injeção direta de amostra de um hospital (HC) de Santa Maria (RS, Brasil), para a determinação de fármacos e metabólitos e posterior estudo de risco ambiental. O método de preparo de amostra combinado apresentado neste estudo teve bons resultados para o screening e a quantificação de fármacos e metabólitos presentes em efluentes hospitalares, com características de complexidade bastante heterogênea. O método de screening, empregando UHPLC-QTOF, possibilitou a identificação de cinco metabólitos e 46 princípios ativos, dos quais 24 foram classificados como suspeitos e 22 confirmados com padrões. O método de quantificação por UHPLCMS/MS teve resposta linear para 35 compostos e foi possível quantificar 22 analitos presentes nas amostras, em uma faixa de 1,17 µgL-1 a 239,64 µgL-1 . Ademais, o método de análise com injeção direta apresentado neste estudo teve bons resultados para a quantificação de 35 compostos, dos quais 7 apresentaram valores a cima do LOQ do método em efluente hospitalar. As amostras do HC apresentaram concentrações em uma faixa de 3,02 µgL-1 a 235,18 µgL-1 . Há indícios da influência das condições climáticas no que diz respeito à concentração dos fármacos presentes no efluente. A avaliação de risco ambiental aprestou valor de RQ>1 para vários compostos quantificados nas amostras de HA e HB, com RQmix na ordem de 30x106 para HA e 20x106 para HB. Os RQmix das amostras do HC ficaram na ordem de 8x104 e 2x105 para inverno e verão, respectivamente. Observa-se que os efluentes dos três hospitais avaliados apresentam risco ambiental para espécies aquáticas e pequenos roedores, baseado nos resultados de RQ e RQmix, e contribuem para o destino e persistência de fármacos no meio ambiente.Coordenação de Aperfeiçoamento de Pessoal de Nível Superior - CAPESporUniversidade Federal de Santa MariaCentro de Ciências Naturais e ExatasPrograma de Pós-Graduação em QuímicaUFSMBrasilQuímicaAttribution-NonCommercial-NoDerivatives 4.0 Internationalhttp://creativecommons.org/licenses/by-nc-nd/4.0/info:eu-repo/semantics/openAccessEfluente hospitalarFármacosAnálise qualitativaAnálise quantitativaAnálise de risco ambientalHospital wastewaterPharmaceuticalsQuantitative analysisQualitative analysisEnvironmental risk assessmentCNPQ::CIENCIAS EXATAS E DA TERRA::QUIMICADeterminação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambientalDetermination of pharmaceuticals in hospital wastewaters using UHPLC-QTOF MS, UHPLC-MS/MS and evaluation of environmentl risk quotientinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/doctoralThesisPrestes, Osmar Damianhttp://lattes.cnpq.br/9632234955509028Sirtori, CarlaAmaral, Camila Costa de AmorimSouza, Darliana MelloGonçalves, Fábio FerreiraBecker, Raquel Wielenshttp://lattes.cnpq.br/0529456264431690Mühlen, Lisandro von100600000000600600600600600600600600f79cc0c9-c923-4244-9c1f-c80d74674410a3b59dbe-5d47-489c-85e1-3bc2c52604d8fe6d02e7-7dd9-4498-8565-b6bb95ce46b86a27ed78-920e-4cfc-8760-b99c8c79c285d33ad996-109a-4356-a60d-468ae8c0b65be18ecce1-8501-4394-8179-133603c19355c3a4ec38-8209-4528-bd91-b4f93e2519bbreponame:Biblioteca Digital de Teses e Dissertações do UFSMinstname:Universidade Federal de Santa Maria (UFSM)instacron:UFSMORIGINALTES_PPGQUIMICA_2023_MUHLEN_LISANDRO.pdfTES_PPGQUIMICA_2023_MUHLEN_LISANDRO.pdfTese de doutoradoapplication/pdf2587995http://repositorio.ufsm.br/bitstream/1/30518/1/TES_PPGQUIMICA_2023_MUHLEN_LISANDRO.pdf6d88ce395a1adcf36f2cf33213e2fc32MD51CC-LICENSElicense_rdflicense_rdfapplication/rdf+xml; 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dc.title.por.fl_str_mv Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
dc.title.alternative.eng.fl_str_mv Determination of pharmaceuticals in hospital wastewaters using UHPLC-QTOF MS, UHPLC-MS/MS and evaluation of environmentl risk quotient
title Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
spellingShingle Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
Mühlen, Lisandro von
Efluente hospitalar
Fármacos
Análise qualitativa
Análise quantitativa
Análise de risco ambiental
Hospital wastewater
Pharmaceuticals
Quantitative analysis
Qualitative analysis
Environmental risk assessment
CNPQ::CIENCIAS EXATAS E DA TERRA::QUIMICA
title_short Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
title_full Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
title_fullStr Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
title_full_unstemmed Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
title_sort Determinação de farmacos em efluentes hospitalares utilizando UHPLC-QTOF MS, UHPLC-MS/MS e avaliação dos quocientes de risco ambiental
author Mühlen, Lisandro von
author_facet Mühlen, Lisandro von
author_role author
dc.contributor.advisor1.fl_str_mv Prestes, Osmar Damian
dc.contributor.advisor1Lattes.fl_str_mv http://lattes.cnpq.br/9632234955509028
dc.contributor.advisor-co1.fl_str_mv Sirtori, Carla
dc.contributor.referee1.fl_str_mv Amaral, Camila Costa de Amorim
dc.contributor.referee2.fl_str_mv Souza, Darliana Mello
dc.contributor.referee3.fl_str_mv Gonçalves, Fábio Ferreira
dc.contributor.referee4.fl_str_mv Becker, Raquel Wielens
dc.contributor.authorLattes.fl_str_mv http://lattes.cnpq.br/0529456264431690
dc.contributor.author.fl_str_mv Mühlen, Lisandro von
contributor_str_mv Prestes, Osmar Damian
Sirtori, Carla
Amaral, Camila Costa de Amorim
Souza, Darliana Mello
Gonçalves, Fábio Ferreira
Becker, Raquel Wielens
dc.subject.por.fl_str_mv Efluente hospitalar
Fármacos
Análise qualitativa
Análise quantitativa
Análise de risco ambiental
topic Efluente hospitalar
Fármacos
Análise qualitativa
Análise quantitativa
Análise de risco ambiental
Hospital wastewater
Pharmaceuticals
Quantitative analysis
Qualitative analysis
Environmental risk assessment
CNPQ::CIENCIAS EXATAS E DA TERRA::QUIMICA
dc.subject.eng.fl_str_mv Hospital wastewater
Pharmaceuticals
Quantitative analysis
Qualitative analysis
Environmental risk assessment
dc.subject.cnpq.fl_str_mv CNPQ::CIENCIAS EXATAS E DA TERRA::QUIMICA
description One of the main sources of pollution of aquatic systems by drugs is the incorrect disposal of hospital effluents (HWW). The HWW matrix is quite complex and therefore its analysis is a challenge, in this context, sample preparation plays an important role in the determination of these substances. The combination of DSPE and SPE techniques was evaluated in the preparation stage of HWW samples, from two hospitals (HA and HB) in Porto Alegre (RS, Brazil), and the use of a method of direct injection of samples from a hospital (HC) in Santa Maria (RS, Brazil), for the determination of pharmaceuticals and metabolites and subsequent study of environmental risk. The combined method presented in this study had was successfully employed for the screening and quantification of pharmacological compounds and metabolites present in hospital effluents, with heterogeneous complexity characteristics. The screening method enabled the identification of five metabolites and 45 active principles, from which 24 were classified as suspect and 22 confirmed with standards. The quantification method had a linear response for 35 compounds and it was possible to quantify 22 analytes present in the samples, in a range from 1.17 µg L-1 to 239.64 µg L-1 . Furthermore, the direct injection analysis method presented in this study was successfully employed for the quantification of 35 compounds, of which up to 7 presented values above the LOQ of the method in hospital effluent. The HC samples showed concentrations in a range of 3.02 µg L-1 to 235.18 µg L-1 . There are indications of climatic conditions influence regarding to the concentration of drugs present in the effluent. The environmental risk assessment provided an RQ value > 1 for several compounds quantified in the HA and HB samples, with RQmix in the order of 30x106 for HA and 20x106 for HB. The RQmix for the samples from HC were in the order of 8x104 and 2x105 , respectively on winter and summer. The effluents from the three evaluated hospitals present an environmental risk for aquatic species and small rodents, based on the results of RQ and RQmix, and contribute to the fate and persistence of drugs in the environment.
publishDate 2023
dc.date.accessioned.fl_str_mv 2023-11-16T19:03:57Z
dc.date.available.fl_str_mv 2023-11-16T19:03:57Z
dc.date.issued.fl_str_mv 2023-10-02
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dc.publisher.none.fl_str_mv Universidade Federal de Santa Maria
Centro de Ciências Naturais e Exatas
dc.publisher.program.fl_str_mv Programa de Pós-Graduação em Química
dc.publisher.initials.fl_str_mv UFSM
dc.publisher.country.fl_str_mv Brasil
dc.publisher.department.fl_str_mv Química
publisher.none.fl_str_mv Universidade Federal de Santa Maria
Centro de Ciências Naturais e Exatas
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