### 杜鹃花科植物有毒成分的电子结构及构效关系

1. 中国人民解放军药物化学研究所
• 出版日期:1992-03-15 发布日期:1992-03-15

### The electronic structure and structure-activity relationship of ericaceous toxins

CHEN CHANG YING;LIU ZHUGUO;PAN XINFU;LIAN HONGSHOU;LI YULIN;CHEN CHUNHUA

• Online:1992-03-15 Published:1992-03-15

The quantum chem. (INDO) calcns. have been undertaken for 9 compounds extracted and separated from Ericaceae plants. Various quantum chem. indexes were calculated and electrostatic potential contour maps were obtained. The authors made a comparison by technol. of mol. graphics for the space structure of these compounds and some alkaloids that the pharmacol. nature are the same as ericaceous toxins. The electronic structure, active site, acting mechanism and relationship between the electronic structure and the toxicity of these compounds were discussed and reasons for the differences of toxicity were explained on the basis of these results.