DOAJ Open Access 2019

Inclusion Behavior of Naringenin/β-Cyclodextrin Supramolecular Complex

YANG Yun-han DU Yao YING Fei-xiang YANG Jun-li XIA Da-zhen +2 lainnya

Abstrak

An inclusion complex of naringenin (NAR) and β-cyclodextrin (βCD) was prepared with ultrasonication. Powder X-ray diffraction (XRD) and infrared absorption spectroscopy (IR) indicated that the inclusion complex formed had some new physical/chemical properties. 1H NMR and ROESY spectroscopy revealed that the stable supramolecular inclusion complex was formed by having the benzene ring of NAR introduced into the big end of the βCD. The formation processes of NAR/βCD inclusion complex were also studied by quantum chemical calculations. It was revealed that enthalpy and hydrogen bonding weak interaction force were the driving forces behind the formation. The optimal inclusion mode obtained from energy gap and binding energy analyses were consistent with the most inclusive mode obtained from molecular docking analysis and the NMR results. These results were further confirmed by ONIOM calculation.

Topik & Kata Kunci

Electricity and magnetism

Penulis (7)

YANG Yun-han

DU Yao

YING Fei-xiang

YANG Jun-li

XIA Da-zhen

XIA Fu-ting

YANG Li-juan

Format Sitasi

APA MLA BibTeX

Yun-han, Y., Yao, D., Fei-xiang, Y., Jun-li, Y., Da-zhen, X., Fu-ting, X. et al. (2019). Inclusion Behavior of Naringenin/β-Cyclodextrin Supramolecular Complex. https://doi.org/10.11938/cjmr20182691

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Informasi Jurnal

Tahun Terbit: 2019
Sumber Database: DOAJ
DOI: 10.11938/cjmr20182691
Akses: Open Access ✓