Theoretical and experimental evidence for the use of natural deep eutectic solvents to increase the solubility and extractability of curcumin

Oualid Alioui,Widad Sobhi,Matteo Tiecco,Inas M. Alnashef,Ayoub Attoui,Amel Boudechicha,Krishna Kumar Yadav,Ahmed M. Fallatah,Noureddine Elboughdiri,Byong-Hun Jeon,Yacine Benguerba

Journal of Molecular Liquids（2022）

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摘要

•NADES investigation using both experimental and modeling methods.•COSMOThermX and AIM were used to investigate how HBAs and HBDs combine and interact.•NADES' components, and water molecules, formed hydrogen bonds.•The computed FTIR spectra agreed with the experimental one.•Curcumin was more soluble in ChCl:Gly NADES than in water.

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关键词

Deep Eutectic Solvents,Curcumin,Solubilization,Choline Chloride,COSMO-RS

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