H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition

Autores
Alonso Salces, Rosa Maria; Segebarth, Nicolás; Garmón Lobato, Sergio; Holland, Margaret V.; Moreno Rojas, José M.; Fernández Pierna, Juan A.; Baeten, Vincent; Fuselli, Sandra R.; Gallo, Blanca; Berrueta, Luis Ángel; Reniero, Fabiano; Guillou, Claude; Héberger, Károly
Año de publicación
2015
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
H-NMR spectral data and H and C isotope abundances of virgin olive oils (VOOs) and their unsaponifiable fractions were analyzed by pattern recognition techniques, such as principal component analysis (PCA) and partial-least squares discriminant analysis (PLS-DA). The aim was to develop chemical tools for the authentication of VOOs according to their geographical origin or protected designation of origin (PDO), as well as to detect the mislabeling of the provenance of VOOs, at the regional or national level, or the mislabeling of non-PDO oils as PDO VOOs. The relationship between stable isotope abundances of the VOOs and their unsaponifiable fractions and the latitude of the VOO geographical origin was confirmed, but these criteria were not completely discriminant to differentiate VOOs according to their geographical origin. However, δ2H and/or δ13C data provided complementary geographical information to 1H-NMR data in the PLS-DA binary classification models afforded for VOOs from Greece, Spain, Italy, Izmir (Turkey), Crete (Greece), and the PDOs Riviera Ligure (Italy) and Huile d'olive d'Aix−en−Provence (France). 2H/1H and 13C/12C ratios of the unsaponifiable fractions of VOOs are reported here for the first time. The present approach for PDO Riviera Ligure VOOs, based on 1H-NMR data and C isotope abundance of the bulk oil and its unsaponifiable fraction, outperformed the previously reported classification models. Moreover, the PLS-DA models to authenticate VOOs from Greece and detect non-Greek VOOs achieved over 93% of correct predictions. Practical applications: The research can be applied in the protection of consumers and honest producers and retailers, and provides potential tools for antifraud authorities and regulatory bodies, which face the challenge of detecting fraudulent practices that do not comply with EU regulations in the trade of VOOs, such as the mislabeling of VOOs produced in a certain geographical origin [Commission Implementing Regulation (EC) no 29/2012 and Commission Implementing Regulation (EC) no 1335/2013] and/or under specific EU quality schemes, named PDO or PGI [Council Regulation (EC) no 510/2006].
Fil: Alonso Salces, Rosa Maria. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Institute of Health and Consumer Protection; Italia
Fil: Segebarth, Nicolás. Institute of Health and Consumer Protection; Italia
Fil: Garmón Lobato, Sergio. Universidad del Pais Vasco; España
Fil: Holland, Margaret V.. Institute of Health and Consumer Protection; Italia
Fil: Moreno Rojas, José M.. Institute of Health and Consumer Protection; Italia
Fil: Fernández Pierna, Juan A.. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; Bélgica
Fil: Baeten, Vincent. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; Bélgica
Fil: Fuselli, Sandra R.. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Provincia de Buenos Aires. Gobernación. Comisión de Investigaciones Científicas; Argentina
Fil: Gallo, Blanca. Universidad del Pais Vasco; España
Fil: Berrueta, Luis Ángel. Universidad del Pais Vasco; España
Fil: Reniero, Fabiano. Institute of Health and Consumer Protection; Italia
Fil: Guillou, Claude. Institute of Health and Consumer Protection; Italia
Fil: Héberger, Károly. Hungarian Academy of Sciences. Research Centre for Natural Sciences; Hungría
Materia
Nuclear Magnetic Resonance
Unsaponifiable Fraction
Olive Oil
Geographical Origin
Chemometrics
Pattern Recognition
Nivel de accesibilidad
acceso abierto
Condiciones de uso
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
Repositorio
CONICET Digital (CONICET)
Institución
Consejo Nacional de Investigaciones Científicas y Técnicas
OAI Identificador
oai:ri.conicet.gov.ar:11336/10932

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spelling H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognitionAlonso Salces, Rosa MariaSegebarth, NicolásGarmón Lobato, SergioHolland, Margaret V.Moreno Rojas, José M.Fernández Pierna, Juan A.Baeten, VincentFuselli, Sandra R.Gallo, BlancaBerrueta, Luis ÁngelReniero, FabianoGuillou, ClaudeHéberger, KárolyNuclear Magnetic ResonanceUnsaponifiable FractionOlive OilGeographical OriginChemometricsPattern Recognitionhttps://purl.org/becyt/ford/1.4https://purl.org/becyt/ford/1H-NMR spectral data and H and C isotope abundances of virgin olive oils (VOOs) and their unsaponifiable fractions were analyzed by pattern recognition techniques, such as principal component analysis (PCA) and partial-least squares discriminant analysis (PLS-DA). The aim was to develop chemical tools for the authentication of VOOs according to their geographical origin or protected designation of origin (PDO), as well as to detect the mislabeling of the provenance of VOOs, at the regional or national level, or the mislabeling of non-PDO oils as PDO VOOs. The relationship between stable isotope abundances of the VOOs and their unsaponifiable fractions and the latitude of the VOO geographical origin was confirmed, but these criteria were not completely discriminant to differentiate VOOs according to their geographical origin. However, δ2H and/or δ13C data provided complementary geographical information to 1H-NMR data in the PLS-DA binary classification models afforded for VOOs from Greece, Spain, Italy, Izmir (Turkey), Crete (Greece), and the PDOs Riviera Ligure (Italy) and Huile d'olive d'Aix−en−Provence (France). 2H/1H and 13C/12C ratios of the unsaponifiable fractions of VOOs are reported here for the first time. The present approach for PDO Riviera Ligure VOOs, based on 1H-NMR data and C isotope abundance of the bulk oil and its unsaponifiable fraction, outperformed the previously reported classification models. Moreover, the PLS-DA models to authenticate VOOs from Greece and detect non-Greek VOOs achieved over 93% of correct predictions. Practical applications: The research can be applied in the protection of consumers and honest producers and retailers, and provides potential tools for antifraud authorities and regulatory bodies, which face the challenge of detecting fraudulent practices that do not comply with EU regulations in the trade of VOOs, such as the mislabeling of VOOs produced in a certain geographical origin [Commission Implementing Regulation (EC) no 29/2012 and Commission Implementing Regulation (EC) no 1335/2013] and/or under specific EU quality schemes, named PDO or PGI [Council Regulation (EC) no 510/2006].Fil: Alonso Salces, Rosa Maria. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Institute of Health and Consumer Protection; ItaliaFil: Segebarth, Nicolás. Institute of Health and Consumer Protection; ItaliaFil: Garmón Lobato, Sergio. Universidad del Pais Vasco; EspañaFil: Holland, Margaret V.. Institute of Health and Consumer Protection; ItaliaFil: Moreno Rojas, José M.. Institute of Health and Consumer Protection; ItaliaFil: Fernández Pierna, Juan A.. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; BélgicaFil: Baeten, Vincent. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; BélgicaFil: Fuselli, Sandra R.. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Provincia de Buenos Aires. Gobernación. Comisión de Investigaciones Científicas; ArgentinaFil: Gallo, Blanca. Universidad del Pais Vasco; EspañaFil: Berrueta, Luis Ángel. Universidad del Pais Vasco; EspañaFil: Reniero, Fabiano. Institute of Health and Consumer Protection; ItaliaFil: Guillou, Claude. Institute of Health and Consumer Protection; ItaliaFil: Héberger, Károly. Hungarian Academy of Sciences. Research Centre for Natural Sciences; HungríaWiley Vch Verlag2015-12info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/10932Alonso Salces, Rosa Maria; Segebarth, Nicolás; Garmón Lobato, Sergio; Holland, Margaret V.; Moreno Rojas, José M.; et al.; H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition; Wiley Vch Verlag; European Journal Of Lipid Science And Technology; 117; 12; 12-2015; 1991-20061438-76971438-9312enginfo:eu-repo/semantics/altIdentifier/url/http://dx.doi.org/10.1002/ejlt.201400243info:eu-repo/semantics/altIdentifier/url/http://onlinelibrary.wiley.com/doi/10.1002/ejlt.201400243/abstract;jsessionid=EDF34491ADD7DAE18715E3BA38BF2F9F.f03t01info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-09-17T11:29:13Zoai:ri.conicet.gov.ar:11336/10932instacron:CONICETInstitucionalhttp://ri.conicet.gov.ar/Organismo científico-tecnológicoNo correspondehttp://ri.conicet.gov.ar/oai/requestdasensio@conicet.gov.ar; lcarlino@conicet.gov.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:34982025-09-17 11:29:13.943CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
title H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
spellingShingle H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
Alonso Salces, Rosa Maria
Nuclear Magnetic Resonance
Unsaponifiable Fraction
Olive Oil
Geographical Origin
Chemometrics
Pattern Recognition
title_short H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
title_full H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
title_fullStr H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
title_full_unstemmed H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
title_sort H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition
dc.creator.none.fl_str_mv Alonso Salces, Rosa Maria
Segebarth, Nicolás
Garmón Lobato, Sergio
Holland, Margaret V.
Moreno Rojas, José M.
Fernández Pierna, Juan A.
Baeten, Vincent
Fuselli, Sandra R.
Gallo, Blanca
Berrueta, Luis Ángel
Reniero, Fabiano
Guillou, Claude
Héberger, Károly
author Alonso Salces, Rosa Maria
author_facet Alonso Salces, Rosa Maria
Segebarth, Nicolás
Garmón Lobato, Sergio
Holland, Margaret V.
Moreno Rojas, José M.
Fernández Pierna, Juan A.
Baeten, Vincent
Fuselli, Sandra R.
Gallo, Blanca
Berrueta, Luis Ángel
Reniero, Fabiano
Guillou, Claude
Héberger, Károly
author_role author
author2 Segebarth, Nicolás
Garmón Lobato, Sergio
Holland, Margaret V.
Moreno Rojas, José M.
Fernández Pierna, Juan A.
Baeten, Vincent
Fuselli, Sandra R.
Gallo, Blanca
Berrueta, Luis Ángel
Reniero, Fabiano
Guillou, Claude
Héberger, Károly
author2_role author
author
author
author
author
author
author
author
author
author
author
author
dc.subject.none.fl_str_mv Nuclear Magnetic Resonance
Unsaponifiable Fraction
Olive Oil
Geographical Origin
Chemometrics
Pattern Recognition
topic Nuclear Magnetic Resonance
Unsaponifiable Fraction
Olive Oil
Geographical Origin
Chemometrics
Pattern Recognition
purl_subject.fl_str_mv https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
dc.description.none.fl_txt_mv H-NMR spectral data and H and C isotope abundances of virgin olive oils (VOOs) and their unsaponifiable fractions were analyzed by pattern recognition techniques, such as principal component analysis (PCA) and partial-least squares discriminant analysis (PLS-DA). The aim was to develop chemical tools for the authentication of VOOs according to their geographical origin or protected designation of origin (PDO), as well as to detect the mislabeling of the provenance of VOOs, at the regional or national level, or the mislabeling of non-PDO oils as PDO VOOs. The relationship between stable isotope abundances of the VOOs and their unsaponifiable fractions and the latitude of the VOO geographical origin was confirmed, but these criteria were not completely discriminant to differentiate VOOs according to their geographical origin. However, δ2H and/or δ13C data provided complementary geographical information to 1H-NMR data in the PLS-DA binary classification models afforded for VOOs from Greece, Spain, Italy, Izmir (Turkey), Crete (Greece), and the PDOs Riviera Ligure (Italy) and Huile d'olive d'Aix−en−Provence (France). 2H/1H and 13C/12C ratios of the unsaponifiable fractions of VOOs are reported here for the first time. The present approach for PDO Riviera Ligure VOOs, based on 1H-NMR data and C isotope abundance of the bulk oil and its unsaponifiable fraction, outperformed the previously reported classification models. Moreover, the PLS-DA models to authenticate VOOs from Greece and detect non-Greek VOOs achieved over 93% of correct predictions. Practical applications: The research can be applied in the protection of consumers and honest producers and retailers, and provides potential tools for antifraud authorities and regulatory bodies, which face the challenge of detecting fraudulent practices that do not comply with EU regulations in the trade of VOOs, such as the mislabeling of VOOs produced in a certain geographical origin [Commission Implementing Regulation (EC) no 29/2012 and Commission Implementing Regulation (EC) no 1335/2013] and/or under specific EU quality schemes, named PDO or PGI [Council Regulation (EC) no 510/2006].
Fil: Alonso Salces, Rosa Maria. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Institute of Health and Consumer Protection; Italia
Fil: Segebarth, Nicolás. Institute of Health and Consumer Protection; Italia
Fil: Garmón Lobato, Sergio. Universidad del Pais Vasco; España
Fil: Holland, Margaret V.. Institute of Health and Consumer Protection; Italia
Fil: Moreno Rojas, José M.. Institute of Health and Consumer Protection; Italia
Fil: Fernández Pierna, Juan A.. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; Bélgica
Fil: Baeten, Vincent. Walloon Agricultural Research Centre. Valorisation of Agricultural Products Department; Bélgica
Fil: Fuselli, Sandra R.. Universidad Nacional de Mar del Plata. Facultad de Ciencias Exactas y Naturales. Departamento de Biología; Argentina. Provincia de Buenos Aires. Gobernación. Comisión de Investigaciones Científicas; Argentina
Fil: Gallo, Blanca. Universidad del Pais Vasco; España
Fil: Berrueta, Luis Ángel. Universidad del Pais Vasco; España
Fil: Reniero, Fabiano. Institute of Health and Consumer Protection; Italia
Fil: Guillou, Claude. Institute of Health and Consumer Protection; Italia
Fil: Héberger, Károly. Hungarian Academy of Sciences. Research Centre for Natural Sciences; Hungría
description H-NMR spectral data and H and C isotope abundances of virgin olive oils (VOOs) and their unsaponifiable fractions were analyzed by pattern recognition techniques, such as principal component analysis (PCA) and partial-least squares discriminant analysis (PLS-DA). The aim was to develop chemical tools for the authentication of VOOs according to their geographical origin or protected designation of origin (PDO), as well as to detect the mislabeling of the provenance of VOOs, at the regional or national level, or the mislabeling of non-PDO oils as PDO VOOs. The relationship between stable isotope abundances of the VOOs and their unsaponifiable fractions and the latitude of the VOO geographical origin was confirmed, but these criteria were not completely discriminant to differentiate VOOs according to their geographical origin. However, δ2H and/or δ13C data provided complementary geographical information to 1H-NMR data in the PLS-DA binary classification models afforded for VOOs from Greece, Spain, Italy, Izmir (Turkey), Crete (Greece), and the PDOs Riviera Ligure (Italy) and Huile d'olive d'Aix−en−Provence (France). 2H/1H and 13C/12C ratios of the unsaponifiable fractions of VOOs are reported here for the first time. The present approach for PDO Riviera Ligure VOOs, based on 1H-NMR data and C isotope abundance of the bulk oil and its unsaponifiable fraction, outperformed the previously reported classification models. Moreover, the PLS-DA models to authenticate VOOs from Greece and detect non-Greek VOOs achieved over 93% of correct predictions. Practical applications: The research can be applied in the protection of consumers and honest producers and retailers, and provides potential tools for antifraud authorities and regulatory bodies, which face the challenge of detecting fraudulent practices that do not comply with EU regulations in the trade of VOOs, such as the mislabeling of VOOs produced in a certain geographical origin [Commission Implementing Regulation (EC) no 29/2012 and Commission Implementing Regulation (EC) no 1335/2013] and/or under specific EU quality schemes, named PDO or PGI [Council Regulation (EC) no 510/2006].
publishDate 2015
dc.date.none.fl_str_mv 2015-12
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
http://purl.org/coar/resource_type/c_6501
info:ar-repo/semantics/articulo
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/11336/10932
Alonso Salces, Rosa Maria; Segebarth, Nicolás; Garmón Lobato, Sergio; Holland, Margaret V.; Moreno Rojas, José M.; et al.; H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition; Wiley Vch Verlag; European Journal Of Lipid Science And Technology; 117; 12; 12-2015; 1991-2006
1438-7697
1438-9312
url http://hdl.handle.net/11336/10932
identifier_str_mv Alonso Salces, Rosa Maria; Segebarth, Nicolás; Garmón Lobato, Sergio; Holland, Margaret V.; Moreno Rojas, José M.; et al.; H-NMR and isotopic fingerprinting of olive oil and its unsaponifiable fraction: Geographical origin of virgin olive oils by pattern recognition; Wiley Vch Verlag; European Journal Of Lipid Science And Technology; 117; 12; 12-2015; 1991-2006
1438-7697
1438-9312
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/url/http://dx.doi.org/10.1002/ejlt.201400243
info:eu-repo/semantics/altIdentifier/url/http://onlinelibrary.wiley.com/doi/10.1002/ejlt.201400243/abstract;jsessionid=EDF34491ADD7DAE18715E3BA38BF2F9F.f03t01
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
eu_rights_str_mv openAccess
rights_invalid_str_mv https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
dc.format.none.fl_str_mv application/pdf
application/pdf
dc.publisher.none.fl_str_mv Wiley Vch Verlag
publisher.none.fl_str_mv Wiley Vch Verlag
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reponame_str CONICET Digital (CONICET)
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repository.name.fl_str_mv CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicas
repository.mail.fl_str_mv dasensio@conicet.gov.ar; lcarlino@conicet.gov.ar
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