Interaction Scheme

Molecule

Untitled
Osthole

c = 75.0 µM

Host

Beta cd
β-CD

c = 0.0 — 8750.0 µM

Binding Properties

𝜈 Molecule 1 : 1 Host
Ka = 122.9 ± M-1
Kd =
logKa = 2.09 ± 0.0
T 25.0 °C 298 K
Energy kJ mol-1 kcal mol-1
ΔG = -11.93 ± 0.0 -2.85 ± 0.0
These are the specifications of the determination of the experimental results.
Detection Method: Direct
Assay Type: Direct Binding Assay
Technique: Fluorescence
𝛌ex = 340.0 nm
𝛌em = 400.0 nm
IboundIfree = 2.6
Detailed information about the solvation.
Solvent System Single Solvent
Solvent water
Please find here information about the dataset this interaction is part of.
Citation:

H. Zhang, H. Zhang, C. Qu, L. Bai, L. Ding, SupraBank 2024, Fluorimetric and mass spectrometric study of the interaction of β-cyclodextrin and osthole (dataset). https://doi.org/10.34804/supra.20210928147

Link: https://doi.org/10.34804/supra.20210928147
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Please find here information about the scholarly article describing the results derived from that data.
Citation:

H. Zhang, H. Zhang, C. Qu, L. Bai, L. Ding, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 2007, 68, 474–477.

Link: https://doi.org/10.1016/j.saa.2006.12.013
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Binding Isotherm Simulations


The plot depicts the binding isotherm simulation of a 1:1 interaction of Osthole (0.16273393002441008 M) and β-CD (0 — 0.32546786004882017 M).