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Citation: Shi Hong-Yun, Wang Yi-Bo, Deng Jie, Zhang Yun-Qian, Zhang Tao. The Structure-activity Relationship of a Series of Nereistoxin Compounds and Isomers[J]. Acta Physico-Chimica Sinica, ;1995, 11(12): 1089-1092. doi: 10.3866/PKU.WHXB19951206 shu

The Structure-activity Relationship of a Series of Nereistoxin Compounds and Isomers

1.
Department of Chemistry,Guizhou University,Guiyang 550025

Received Date: 2 March 1995
Available Online: 15 December 1995

Geometries and electronic properties of a series of nereistoxin compounds and isomer, dihydronereistoxin, dithiocyanate ester, padan and sha chong dan have been calculated using MNDO- PM3 method. The relationship of molecular geometries, electronic properties and biological activities of these compounds is discussed in the article.
- Nereistoxin compound,
- MNDO-PM3,
- Geometries,
- Electronic properties
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