Origins Determination of Herba Abri cantoniensis and Herba Abri mollis with FTIR Combined with Fuzzy Cluster and Curve-Fitting
WANG Yi-bing1, CHEN Zhi-cheng1,2, WU Wei-hong3, KONG De-xin4, HUANG Rong-shao4, LIU Jun-xian2, HUANG Shu-shi1*
1. Lab of Biophysics, Guangxi Academy of Sciences, Nanning 530007, China 2. College of Physics and Electronic Engineering, Guangxi Normal University, Guilin 541004, China 3. Guangxi University of Technology, Liuzhou 545006, China 4. College of Agriculture, Guangxi University, Nanning 530007, China
Abstract:The methods of fuzzy cluster and curve-fitting combined with FTIR were used to determine the origins of Herba Abri cantoniensis and Herba Abri mollis. The spectra of Herba Abri cantoniensis and Herba Abri mollis are similar, both with typical spectral shapes. The two spectra can be divided into 3 parts: the 1st is 3 500-2 800 cm-1, containing stretching bands of —OH, N—H, and CH2; the 2nd is 1 800-800 cm-1, containing stretching bands of ester carbonyl group and indican C—O(H), vibrational bands of CC and benzene ring; The 3rd is 800-400 cm-1, containing skeletal vibration and scissoring vibration of molecular. The recorded FTIR spectral data were processed by 9-point-smoothing, 1st derivative, SNV and fuzzy cluster analysis sequentially. The fuzzy cluster analysis was carried out by similarity or dissimilarity matrix, and two matrices are computed with Manhattan and Euclidean distance. The results indicated that the optimization used Manhattan and dissimilarity matrix, and 5 origins of Herba Abri cantoniensis were perfectly discriminated, but 2 origins of Herba Abri mollis were mixed and identified from the other 3 origins. So the characterized bands at 1 034 cm-1 of the average 1-D spectra of Herba Abri cantoniensis and Herba Abri mollis were fitted combining 2nd derivative for further distinguishing their spectral characteristic. The results of curve-fitting showed that the bands of wild Herba Abri cantoniensis and the other origin ones were decomposed to 11 and 9 component bands respectively, but the bands of Shanglin and the other origins Herba Abri mollis were decomposed to 9 and 8 component bands dissimilarly, and the locations and normalized densities of these component bands were different. From this, together with the results of fuzzy cluster analysis, it is concluded that the combination of two methods may identify the origins of Herba Abri cantoniensis and Herba Abri mollis availably.
[1] BAI Long-hua, DONG Qing-song, PU Rui-ling(白隆华,董青松,蒲瑞翎). Guangxi Agricultural Sciences(广西农业科学), 2005, 36(5): 476. [2] LIU Chuan-ming(刘传明). Lishizhen Medicine and Materia Medica Reseach(时珍国医国药), 2004, 15(11): 767. [3] SHI Hai-ming, WEN Jing, TU Peng-fei(史海明,温 晶,屠鹏飞). Chinese Traditional and Herbal Drugs(中草药), 2006, 37(11): 1610. [4] HUANG Rong-shao, YU Yong-xiong, HU Yan, et al(黄荣韶,玉永雄,胡 艳,等). China Journal of Chinese Materia Medica(中国中药杂志), 2006, 31(17): 1429. [5] WANG Jian, LU Shan-dan, YANG Fu-shun, et al(王 建,陆善旦,杨福顺,等). Research and Practice of Chinese Medicines(现代中药研究与实践), 1997, 11(3): 28. [6] LIANG Bi-yan, LI Shu-yuan, SUN Su-qin(梁碧燕,李书渊,孙素琴). Spectroscopy and Spectral Analysis(光谱学与光谱分析), 2009, 29(2): 313. [7] SUN Yuan-lin, SHEN Rui-ling, TANG Jian, et al(孙元琳,申瑞玲,汤 坚,等). Chinese Journal of Analytical Chemistry(分析化学), 2008, 36(3): 348. [8] JIANG Da-cheng, WANG Yong-sheng, WENG Li-li(姜大成,王永生,翁丽丽). Spectra Identify of Common Chinese Traditional Medicine(常用中药光谱鉴定). Beijing: Chemical Industry Press(北京:化学工业出版社), 2006. 37. [9] WU Jin-guang(吴瑾光). Technology and Application of Latter-day Fourier Transform Infrared Spectroscopy(近代傅里叶变换红外光谱技术及应用). Beijing: Science and Technology Literature Publishing House(北京:科技文献出版社), 1994. 57.