结构-气味关系:应用电子拓扑方法的结果。

N M Shvets, A S Dimoglo
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引用次数: 23

摘要

利用电子拓扑方法研究化合物的结构与结构之间的关系。对该方法的特点作了简要说明。举例说明了檀香、龙涎香、大蒜香味和肉类香味在食品添加剂中的应用。揭示了影响气味外观的结构碎片,并讨论了它们的电子和拓扑特性。后者被制定为具有特殊性质的新化合物活性预测的规则。
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Structure-odour relationships: results of an applied electron-topological approach.

Relationships between odour and chemical structure of compounds are studied by means of the electron-topological method developed for structure/activity research especially. A brief explanation is given for distinguished features of the method. Application examples are demonstrated for sandalwood, ambergris odour, garlic aroma and meat keynotes in food additives. The structural fragments affecting the odour appearance are revealed and discussed with respect to their electronic and topological peculiarities. The latter are formulated as rules for activity prediction of new compounds with special properties.

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