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Extraction and Crystal Structure of Karounidiol
作者姓名:巢志茂  王诚
作者单位:CHAO Zhi-Maoa WANG Chengb a (Institute of Chinese Materia Medica,China Academy of Traditional Chinese Medicine,Beijing 100700,China) b (Institute of Materia Medica,Peking Union Medical College and Chinese Academy of Medical Sciences,Beijing 100050,China)
基金项目:the State Science and Technology Commission (No. 96-903-02-02)
摘    要:1 INTRODUCTION Karounidiol is a natural pentacyclic triterpene compound, which was identified as a novel compound initially from the Japanese commercial seeds of Trichosanthes kirilowii Maxim. (Fam. Cucurbitaceae)1], and then isolated from the Chinese commercial seeds of T. kirilowii Maxim. and T. rosthornii Harms2, 3] and the Japanese wild plant seeds of T. cucumeroides (Ser.) Maxim.4]. It has not been isolated from other plants up to now, so we are thinking about how to use th…

关 键 词:萃取  晶体结构  天然五环三萜化合物  中药  X射线分析  栝楼  植物药

Extraction and Crystal Structure of Karounidiol
CHAO Zhi-Maoa,WANG Chengb a.Extraction and Crystal Structure of Karounidiol[J].Chinese Journal of Structural Chemistry,2003,22(4):431-434.
Authors:CHAO Zhi-Maoa  WANG Chengb a
Abstract:The title compound of karounidiol (C30H48O2), a main active triterpene component of snakegourd seed, was isolated from unsaponifiable matter of the seed oil of Trichosanthes kirilowii Maxim., and characterized by X-ray diffraction analysis. It crystallizes in orthorhombic system, space group P212121 with C30H48O2·CH3OH·H2O (C31H54O4), a = 7.515(1), b = 14.407(1), c = 27.799(2) (A。), V = 3009.8(5)(A。)3, Z = 4, Dx = 1.087 g/cm3, Mr = 490.77, F(000) = 1088 and μ = 0.086 mm-1. The final R = 0.0840 and wR = 0.2289 for 2752 observed reflections (|F|2 ≥ 2σ|F|2). The molecular crystal structure of karounidiol shows relative stereochemistry of (3α,13α,14β, 20α)-3,29-dihydroxy-13-methyl-26-norolean-7,9(11)-diene. The molecule is composed of five six- membered rings with ring junctures of A/B trans, C/D trans and D/E cis.
Keywords:karounidiol  crystal structure  Trichosanthes kirilowii  triterpene
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