A quantum chemical and statistical study of cytotoxic activity of compounds isolated from Curcuma zedoaria

A quantum chemical and statistical study of cytotoxic activity of compounds isolated from Curcuma zedoaria

A series of 21 compounds isolated from Curcuma zedoaria was subjected to cytotoxicity test against MCF7; Ca Ski; PC3 and HT-29 cancer cell lines; and a normal HUVEC cell line. To rationalize the structure–activity relationships of the isolated compounds; a set of electronic; steric and hydrophobic d...

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Bibliographic Details
Main Authors: Al Trabolsy, Z.B.K (Author), Anouar, E.H (Author), Awang, K. (Author), Hamdi, O.A.A (Author), Malek, S.N.A (Author), Rahman, S.N.S.A (Author), Shilpi, J.A (Author), Weber, J.-F.F (Author), Zain, S.B.M (Author), Zakaria, N.S.S (Author), Zulkefeli, M. (Author)
Format: Article
Language:English
Published: MDPI AG 2015
Subjects:
Article
Ca Ski cell line
calcium
Calcium
calculation
cancer cell line
Cell Line, Tumor
chemical structure
chemistry
cluster analysis
Cluster Analysis
comosone 2
controlled study
correlation coefficient
Curcuma
Curcuma zedoaria
Curcuma zedoaria extract
curcumanolide A
curcumenol
curcumenone
curcuzedoalide
curdione
curzerenone
cytotoxicity
Cytotoxicity
cytotoxicity assay
dehydrocurdione
density functional theory
DFT
diterpene
Diterpenes
drug effects
drug isolation
drug screening
Drug Screening Assays, Antitumor
extraction
furanodiene
furanodienone
germacrone
germacrone 1, 10 epoxide
germacrone 4, 5 epoxide
gweicurculactone
HT 29 cell line
HT-29 cell line
HT29 Cells
human
human cell
Human Umbilical Vein Endothelial Cells
Humans
IC50
Inhibitory Concentration 50
isoprocurcumenol
labda 8(17), 12 diene 15,15 dimethoxy 16 al
labda 8(17),12 diene 15,16 dial
Linear Models
MCF 7 cell line
MCF-7 cell line
MCF-7 Cells
Molecular Structure
multiple linear regression analysis
nonhuman
nuclear magnetic resonance spectroscopy
PC 3 cell line
Phytochemicals
plant medicinal product
principal component analysis
Principal Component Analysis
procurcumenol
QSAR
quantitative structure activity relation
Quantitative Structure-Activity Relationship
quantum chemistry
quantum theory
Quantum Theory
regression analysis
Regression Analysis
sesquiterpene
Sesquiterpenes
simple linear regression analysis
statistical analysis
statistical model
tumor cell line
umbilical vein endothelial cell
unclassified drug
zederone
zerumbone epoxide
zerumin A
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