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https://doi.org/10.37358/Rev.Chim.1949

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Revista de Chimie (Rev. Chim.), Year 2017, Volume 68, Issue 8, 1776-1779

https://doi.org/10.37358/RC.17.8.5763

Renata Maria Varut, Luciana Teodora Rotaru, Marius Ciprian Varut

QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC

Abstract:

Polyphenols are important constituents of plants, being demonstrated that long term consumption of them have potential health benefits as antioxidant. In the experimental part of the study we separated ten polyphenolic compounds by thin layer chromatography (TLC) from hydroalcoholic hypoglycemic plant extracts (Ericaceae family). In the theoretical study part we consider important to characterize the structural properties of the substances using molecular mechanics studies. The selected physico-chemical descriptors were: HOMO and LUMO orbitals frontier, water solubility, partition coefficient, dipole moment, heat of formation, stabilization energy of the molecule and number of proton donor groups. We realized a comparative QSPR regression correlation study of molecular surface area and Rf with the selected desriptors. From studies we observed the relationship between the two parameters Rf and MSA, which correlates very well with common descriptors.
Keywords:
antioxidants; TLC; QSPR

Issue: 2017, Volume 68, Issue 8
Pages: 1776-1779
Publication date: 2017/9/15
https://doi.org/10.37358/RC.17.8.5763
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Creative Commons License
This article is published under the Creative Commons Attribution 4.0 International License
Citation Styles
Cite this article as:
VARUT, R.M., ROTARU, L.T., VARUT, M.C., QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC, Rev. Chim., 68(8), 2017, 1776-1779.

Vancouver
Varut RM, Rotaru LT, Varut MC. QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC. Rev. Chim.[internet]. 2017 Aug;68(8):1776-1779. Available from: https://doi.org/10.37358/RC.17.8.5763


APA 6th edition
Varut, R.M., Rotaru, L.T. & Varut, M.C. (2017). QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC. Revista de Chimie, 68(8), 1776-1779. https://doi.org/10.37358/RC.17.8.5763


Harvard
Varut, R.M., Rotaru, L.T., Varut, M.C. (2017). 'QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC', Revista de Chimie, 68(8), pp. 1776-1779. https://doi.org/10.37358/RC.17.8.5763


IEEE
R.M. Varut, L.T. Rotaru, M.C. Varut, "QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC". Revista de Chimie, vol. 68, no. 8, pp. 1776-1779, 2017. [online]. https://doi.org/10.37358/RC.17.8.5763


Text
Renata Maria Varut, Luciana Teodora Rotaru, Marius Ciprian Varut,
QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC,
Revista de Chimie,
Volume 68, Issue 8,
2017,
Pages 1776-1779,
ISSN 2668-8212,
https://doi.org/10.37358/RC.17.8.5763.
(https://revistadechimie.ro/Articles.asp?ID=5763)
Keywords: antioxidants; TLC; QSPR


RIS
TY - JOUR
T1 - QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC
A1 - Varut, Renata Maria
A2 - Rotaru, Luciana Teodora
A3 - Varut, Marius Ciprian
JF - Revista de Chimie
JO - Rev. Chim.
PB - Revista de Chimie SRL
SN - 2668-8212
Y1 - 2017
VL - 68
IS - 8
SP - 1776
EP - 1779
UR - https://doi.org/10.37358/RC.17.8.5763
KW - antioxidants
KW - TLC
KW - QSPR
ER -


BibTex
@article{RevCh2017P1776,
author = {Varut Renata Maria and Rotaru Luciana Teodora and Varut Marius Ciprian},
title = {QSPR Correlation of Physico-chemical Descriptors with the Molecular Surface Area and Rf of Ten Polyphenolic Compounds, Separated from Vegetal Extracts by TLC},
journal = {Revista de Chimie},
volume = {68},
number = {8},
pages = {1776-1779},
year = {2017},
issn = {2668-8212},
doi = {https://doi.org/10.37358/RC.17.8.5763},
url = {https://revistadechimie.ro/Articles.asp?ID=5763}
}
 
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