Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis

Detalhes bibliográficos
Autor(a) principal: Moraes, Francisca Pereira de
Data de Publicação: 2019
Outros Autores: Costa, Rosangela Câmara, Morais, Camilo de Lelis Medeiros de, Medeiros, Fábio Gonçalves Macêdo de, Fernandes, Tássia Rayane Nascimento, Hoskin, Roberta Targino, Lima, Kássio Michell Gomes de
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Institucional da UFRN
Texto Completo: https://repositorio.ufrn.br/handle/123456789/45378
Resumo: Acerola fruit is one of the richest natural sources of ascorbic acid ever known. As a consequence, acerola fruit and its products are demanded worldwide for the production of health supplements and the development of functional products. However, the analytical determination of ascorbic acid is time-consuming and costly. In this study, we show a non-destructive, reliable, and fast method to measure the ascorbic acid content in intact acerola, using near-infrared spectroscopy (NIRS) associated with multivariate calibration methods. Models using variable selection by means of interval partial least squares (iPLS) and a genetic algorithm (GA) were tested. The best model for ascorbic acid content, based on the prediction performance, was the GA-PLS method with second derivative spectral pretreatment, with a root mean square error of cross-validation equal to 22.9 mg/100 g, root mean square error of prediction equal to 46.3 mg/100 g, ratio of prediction to deviation equal to 8.0, determination coefficient for calibration equal to 0.98 and determination coefficient for prediction equal to 0.96. The current methodology, using NIR spectroscopy and chemometrics, is a promising and rapid tool to determine the ascorbic acid content of intact acerola fruit
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spelling Moraes, Francisca Pereira deCosta, Rosangela CâmaraMorais, Camilo de Lelis Medeiros deMedeiros, Fábio Gonçalves Macêdo deFernandes, Tássia Rayane NascimentoHoskin, Roberta TarginoLima, Kássio Michell Gomes de2021-12-15T14:39:12Z2021-12-15T14:39:12Z2019MORAES, Francisca; COSTA, Rosangela; MORAIS, Camilo; MEDEIROS, Fábio; FERNANDES, Tássia; HOSKIN, Roberta ; LIMA, Kássio. Estimation of Ascorbic Acid in Intact Acerola (Malpighia emarginata DC) Fruit by NIRS and Chemometric Analysis. Horticulturae, v. 5, p. 12, 2019. Disponível em: https://www.mdpi.com/2311-7524/5/1/12. Acesso em: 04 nov. 2021. https://doi.org/10.3390/horticulturae50100122311-7524https://repositorio.ufrn.br/handle/123456789/4537810.3390/horticulturae5010012MDPIAttribution 3.0 Brazilhttp://creativecommons.org/licenses/by/3.0/br/info:eu-repo/semantics/openAccessAcerolaNIRSPLSiPLSGA-PLSascorbic acidEstimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysisinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleAcerola fruit is one of the richest natural sources of ascorbic acid ever known. As a consequence, acerola fruit and its products are demanded worldwide for the production of health supplements and the development of functional products. However, the analytical determination of ascorbic acid is time-consuming and costly. In this study, we show a non-destructive, reliable, and fast method to measure the ascorbic acid content in intact acerola, using near-infrared spectroscopy (NIRS) associated with multivariate calibration methods. Models using variable selection by means of interval partial least squares (iPLS) and a genetic algorithm (GA) were tested. The best model for ascorbic acid content, based on the prediction performance, was the GA-PLS method with second derivative spectral pretreatment, with a root mean square error of cross-validation equal to 22.9 mg/100 g, root mean square error of prediction equal to 46.3 mg/100 g, ratio of prediction to deviation equal to 8.0, determination coefficient for calibration equal to 0.98 and determination coefficient for prediction equal to 0.96. The current methodology, using NIR spectroscopy and chemometrics, is a promising and rapid tool to determine the ascorbic acid content of intact acerola fruitengreponame:Repositório Institucional da UFRNinstname:Universidade Federal do Rio Grande do Norte (UFRN)instacron:UFRNORIGINALEstimationAscorbicAcid_HOSKIN_2019.pdfEstimationAscorbicAcid_HOSKIN_2019.pdfapplication/pdf965346https://repositorio.ufrn.br/bitstream/123456789/45378/1/EstimationAscorbicAcid_HOSKIN_2019.pdf5c59687ddd74f743465f188638ceb13dMD51CC-LICENSElicense_rdflicense_rdfapplication/rdf+xml; charset=utf-8914https://repositorio.ufrn.br/bitstream/123456789/45378/2/license_rdf4d2950bda3d176f570a9f8b328dfbbefMD52LICENSElicense.txtlicense.txttext/plain; charset=utf-81484https://repositorio.ufrn.br/bitstream/123456789/45378/3/license.txte9597aa2854d128fd968be5edc8a28d9MD53123456789/453782021-12-15 11:39:13.132oai:https://repositorio.ufrn.br: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Repositório de PublicaçõesPUBhttp://repositorio.ufrn.br/oai/opendoar:2021-12-15T14:39:13Repositório Institucional da UFRN - Universidade Federal do Rio Grande do Norte (UFRN)false
dc.title.pt_BR.fl_str_mv Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
title Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
spellingShingle Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
Moraes, Francisca Pereira de
Acerola
NIRS
PLS
iPLS
GA-PLS
ascorbic acid
title_short Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
title_full Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
title_fullStr Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
title_full_unstemmed Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
title_sort Estimation of ascorbic acid in intact acerola (Malpighia emarginata DC) fruit by NIRS and chemometric analysis
author Moraes, Francisca Pereira de
author_facet Moraes, Francisca Pereira de
Costa, Rosangela Câmara
Morais, Camilo de Lelis Medeiros de
Medeiros, Fábio Gonçalves Macêdo de
Fernandes, Tássia Rayane Nascimento
Hoskin, Roberta Targino
Lima, Kássio Michell Gomes de
author_role author
author2 Costa, Rosangela Câmara
Morais, Camilo de Lelis Medeiros de
Medeiros, Fábio Gonçalves Macêdo de
Fernandes, Tássia Rayane Nascimento
Hoskin, Roberta Targino
Lima, Kássio Michell Gomes de
author2_role author
author
author
author
author
author
dc.contributor.author.fl_str_mv Moraes, Francisca Pereira de
Costa, Rosangela Câmara
Morais, Camilo de Lelis Medeiros de
Medeiros, Fábio Gonçalves Macêdo de
Fernandes, Tássia Rayane Nascimento
Hoskin, Roberta Targino
Lima, Kássio Michell Gomes de
dc.subject.por.fl_str_mv Acerola
NIRS
PLS
iPLS
GA-PLS
ascorbic acid
topic Acerola
NIRS
PLS
iPLS
GA-PLS
ascorbic acid
description Acerola fruit is one of the richest natural sources of ascorbic acid ever known. As a consequence, acerola fruit and its products are demanded worldwide for the production of health supplements and the development of functional products. However, the analytical determination of ascorbic acid is time-consuming and costly. In this study, we show a non-destructive, reliable, and fast method to measure the ascorbic acid content in intact acerola, using near-infrared spectroscopy (NIRS) associated with multivariate calibration methods. Models using variable selection by means of interval partial least squares (iPLS) and a genetic algorithm (GA) were tested. The best model for ascorbic acid content, based on the prediction performance, was the GA-PLS method with second derivative spectral pretreatment, with a root mean square error of cross-validation equal to 22.9 mg/100 g, root mean square error of prediction equal to 46.3 mg/100 g, ratio of prediction to deviation equal to 8.0, determination coefficient for calibration equal to 0.98 and determination coefficient for prediction equal to 0.96. The current methodology, using NIR spectroscopy and chemometrics, is a promising and rapid tool to determine the ascorbic acid content of intact acerola fruit
publishDate 2019
dc.date.issued.fl_str_mv 2019
dc.date.accessioned.fl_str_mv 2021-12-15T14:39:12Z
dc.date.available.fl_str_mv 2021-12-15T14:39:12Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
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status_str publishedVersion
dc.identifier.citation.fl_str_mv MORAES, Francisca; COSTA, Rosangela; MORAIS, Camilo; MEDEIROS, Fábio; FERNANDES, Tássia; HOSKIN, Roberta ; LIMA, Kássio. Estimation of Ascorbic Acid in Intact Acerola (Malpighia emarginata DC) Fruit by NIRS and Chemometric Analysis. Horticulturae, v. 5, p. 12, 2019. Disponível em: https://www.mdpi.com/2311-7524/5/1/12. Acesso em: 04 nov. 2021. https://doi.org/10.3390/horticulturae5010012
dc.identifier.uri.fl_str_mv https://repositorio.ufrn.br/handle/123456789/45378
dc.identifier.issn.none.fl_str_mv 2311-7524
dc.identifier.doi.none.fl_str_mv 10.3390/horticulturae5010012
identifier_str_mv MORAES, Francisca; COSTA, Rosangela; MORAIS, Camilo; MEDEIROS, Fábio; FERNANDES, Tássia; HOSKIN, Roberta ; LIMA, Kássio. Estimation of Ascorbic Acid in Intact Acerola (Malpighia emarginata DC) Fruit by NIRS and Chemometric Analysis. Horticulturae, v. 5, p. 12, 2019. Disponível em: https://www.mdpi.com/2311-7524/5/1/12. Acesso em: 04 nov. 2021. https://doi.org/10.3390/horticulturae5010012
2311-7524
10.3390/horticulturae5010012
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http://creativecommons.org/licenses/by/3.0/br/
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