An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus

Relevance of the study: The quantification of endogenous substances is an important task in experimental and clinical pharmacology. In the case of working with endogenous compounds, certain difficulties arise. The main one is the impossibility of obtaining the same biomatrix without endogenous compo...

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Main Authors: V. V. Smirnov, L. M. Krasnykh, G. V. Ramenskaya, S. B. Kazanbekov
Format: Article
Language:Russian
Published: LLC “Publisher OKI” 2022-01-01
Series:Фармакокинетика и Фармакодинамика
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Online Access:https://www.pharmacokinetica.ru/jour/article/view/282
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author V. V. Smirnov
L. M. Krasnykh
G. V. Ramenskaya
S. B. Kazanbekov
author_facet V. V. Smirnov
L. M. Krasnykh
G. V. Ramenskaya
S. B. Kazanbekov
author_sort V. V. Smirnov
collection DOAJ
description Relevance of the study: The quantification of endogenous substances is an important task in experimental and clinical pharmacology. In the case of working with endogenous compounds, certain difficulties arise. The main one is the impossibility of obtaining the same biomatrix without endogenous compounds for use as standard solutions in the construction of calibration curves. Purpose: The aim of our study was to develop a mathematical methodology for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows us to obtain a statistically reliable interval estimation of the concentration of endogenous compounds. Materials and methods: To implement the computational part of the proposed algorithm, the Mathcad engineering calculation program version 15.0 from PTC (Parametric Technology Corporation) is used, which operates under the family of Windows operating systems (XP, 7, Vista, 8). Main results: A mathematical methodology has been developed for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows one to obtain a statistically reliable interval estimate of the concentration of endogenous compounds. A feature of this technique is the use of an exclusively analyzed bioobject for quantitative determination of endogenous substances, without the use of so-called “pure” bioobjects for calibration curves, as well as expensive deuterated analogs of markers – substrates of CYP450 isoenzymes and their metabolites. This allows you to maintain the original biomatrix effect when removing the chromatogram. A statistical apparatus is also used to eliminate possible gross errors. To confirm the reliability of the developed method of quantitative determination, the convergence of the results obtained by this method using deuterated standards is established. Conclusions: A mathematical methodology has been developed for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows one to obtain a statistically reliable interval estimate of the concentration of endogenous compounds. A feature of this technique is the use of only the analyzed bioobject for quantitative determination of endogenous substances, which allows you to maintain the original biomatrix effect when removing the chromatogram.
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series Фармакокинетика и Фармакодинамика
spelling doaj-art-995995fac907410ba96ec6c2f673fce52025-08-20T02:49:52ZrusLLC “Publisher OKI”Фармакокинетика и Фармакодинамика2587-78362686-88302022-01-0102111810.37489/2587-7836-2021-2-11-18271An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatusV. V. Smirnov0L. M. Krasnykh1G. V. Ramenskaya2S. B. Kazanbekov3FSBI «Scientific Centre for Expert Evaluation of Medicinal Products» of the Ministry of Health of the Russian Federation; FSAEI HE I.M. Sechenov First MSMU MOH Russia (Sechenovskiy Uneversity)FSBI «Scientific Centre for Expert Evaluation of Medicinal Products» of the Ministry of Health of the Russian FederationFSBI «Scientific Centre for Expert Evaluation of Medicinal Products» of the Ministry of Health of the Russian Federation; FSAEI HE I.M. Sechenov First MSMU MOH Russia (Sechenovskiy Uneversity)FSAEI HE I.M. Sechenov First MSMU MOH Russia (Sechenovskiy Uneversity)Relevance of the study: The quantification of endogenous substances is an important task in experimental and clinical pharmacology. In the case of working with endogenous compounds, certain difficulties arise. The main one is the impossibility of obtaining the same biomatrix without endogenous compounds for use as standard solutions in the construction of calibration curves. Purpose: The aim of our study was to develop a mathematical methodology for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows us to obtain a statistically reliable interval estimation of the concentration of endogenous compounds. Materials and methods: To implement the computational part of the proposed algorithm, the Mathcad engineering calculation program version 15.0 from PTC (Parametric Technology Corporation) is used, which operates under the family of Windows operating systems (XP, 7, Vista, 8). Main results: A mathematical methodology has been developed for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows one to obtain a statistically reliable interval estimate of the concentration of endogenous compounds. A feature of this technique is the use of an exclusively analyzed bioobject for quantitative determination of endogenous substances, without the use of so-called “pure” bioobjects for calibration curves, as well as expensive deuterated analogs of markers – substrates of CYP450 isoenzymes and their metabolites. This allows you to maintain the original biomatrix effect when removing the chromatogram. A statistical apparatus is also used to eliminate possible gross errors. To confirm the reliability of the developed method of quantitative determination, the convergence of the results obtained by this method using deuterated standards is established. Conclusions: A mathematical methodology has been developed for calculating the concentration of endogenous compounds in biological objects measured by chromatography, which allows one to obtain a statistically reliable interval estimate of the concentration of endogenous compounds. A feature of this technique is the use of only the analyzed bioobject for quantitative determination of endogenous substances, which allows you to maintain the original biomatrix effect when removing the chromatogram.https://www.pharmacokinetica.ru/jour/article/view/282cyp3a4метаболическая активностьфенотипированиекортизолкритерий колмогоровакритерий пирсонакритерий граббса
spellingShingle V. V. Smirnov
L. M. Krasnykh
G. V. Ramenskaya
S. B. Kazanbekov
An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
Фармакокинетика и Фармакодинамика
cyp3a4
метаболическая активность
фенотипирование
кортизол
критерий колмогорова
критерий пирсона
критерий граббса
title An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
title_full An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
title_fullStr An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
title_full_unstemmed An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
title_short An approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
title_sort approach to the quantitative determination of endogenous substances in biological fluids by a chromatographic method using a mathematical apparatus
topic cyp3a4
метаболическая активность
фенотипирование
кортизол
критерий колмогорова
критерий пирсона
критерий граббса
url https://www.pharmacokinetica.ru/jour/article/view/282
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