CAJ | 학술논문

通过CAChe软件模拟环糊精衍生物包合丹皮酚的过程,结果表明羟丙基-β-环糊精(HP-β-CD)的包合效果好,并在后续试验中得到验证.采用正交试验优化了HP-β-CD包合丹皮酚的工艺条件.用紫外扫描与红外光谱法确证丹皮酚被HP-β-CD包合.
통과CAChe연건모의배호정연생물포합단피분적과정,결과표명간병기-β-배호정(HP-β-CD)적포합효과호,병재후속시험중득도험증.채용정교시험우화료HP-β-CD포합단피분적공예조건.용자외소묘여홍외광보법학증단피분피HP-β-CD포합.
A series of semi-empirical molecular orbital calculations with CAChe software were used to imitate the inclusion process of β-cyclodextrin derivatives and paeonol. The results showed that hydroxypropyl-β-cyclodextrin (HP-β-CD) performed the best inclusion effect among the tested derivatives. This imitative result was verified by the further experiments. The inclusion conditions were further optimized by orthogonal test. It was verified that paeonol was included by HP-β-CD by UV and IR spectroscopies.