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yjl2007

金虫 (正式写手)

[求助] 求助一化合物微谱数据结构

化合物13C谱数据如下,溶剂是DMSO:
35.6,48.7,67.7,70.0,71.0,73.1,101.3,114.4,114.9,115.9,121.5,125.7,145.2,145.8,148.5,165.9,175.2
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wq0616

铁杆木虫 (正式写手)

【答案】应助回帖

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yjl2007: 金币+60 2012-11-15 20:53:00
相似度大于80%的有

1 .     chlorogenic acid
C16H18O9     相似度:88.2%
Chemical & Pharmaceutical Bulletin          1991          39          865-870
Studies on the Constituents of the Bark of Kalopanax pictus NAKAI
Kazuko SANO,Shuichi SANADA,Yoshiteru IDA and Junzo SHOJI
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




2 .     chlorogenic acid
    相似度:88.2%
Chemistry of Natural Compounds          2006          42          567-570
NEW THIAZINEDIONES AND OTHER COMPONENTS FROM Xanthium strumarium
Ting Han, Huiliang Li, Qiaoyan Zhang,Hanchen Zheng, and Luping Qin
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




3 .     Chlorogenic acid
C16H18O9     相似度:88.2%
Molecules          2008          13          2796-2803
A New Phloroglucinol Diglycoside Derivative from Hypericum japonicum Thunb.
Xiao W. Wang, Yu Mao, Nai-Li Wang and Xin S. Yao
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




4 .     Chlorogenic acid
    相似度:88.2%
Archives of Pharmacal Research          2011          Vol 34, No 9          1561-1569
Inhibition of 5-Lipoxygenase and Skin Inflammation by the Aerial Parts of Artemisia capillaris and its Constituents
Oh Song Kwon, Jae Sue Choi, Md. Nurul Islam, Yeong Shik Kim, and Hyun Pyo Kim
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




5 .     chlorogenic
    相似度:88.2%
Chinese Traditional and Herbal Drugs          2008          39          21-23
半枝莲化学成分的研究
仲浩;薛晓霞;姚庆强
Structure     13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




6 .     1-O-caffeoylquinic acid
C16H18O9     相似度:88.2%
Chinese Journal of Natural Medicines          2006          4          45-48
Chemical Constituents in Bud of Lonicera macranthoides
XU Xiao-Fang; LI Hui-Jun; Li Ping; FENG Xu; YUAN Chang-Qi
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




7 .     Chlorogenic acid
    相似度:88.2%
Natural Product Sciences          2010          16          20-25
Isolation of Phenolics, Nucleosides, Saccharides and an Alkaloid from the root of Aralia cordata
Hyun, Sook-Kyung; Jung, Hyun-Ah; Min, Byung-Sun; Jung, Jee-H.; Choi, Jae-Sue
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




8 .     Neochlorogenic acid
    相似度:88.2%
Natural Product Sciences          2010          16          20-25
Isolation of Phenolics, Nucleosides, Saccharides and an Alkaloid from the root of Aralia cordata
Hyun, Sook-Kyung; Jung, Hyun-Ah; Min, Byung-Sun; Jung, Jee-H.; Choi, Jae-Sue
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




9 .     chlorogenic acid
    相似度:88.2%
Chinese Pharmaceutical Journal          2005          40          1859-1861
Study on chemical constitutes of Smallanthus sonchifolius
TAN Cheng-yu, HU Jian-en, WANG Huan-di, DU Yu-guang, BAI Xue-fang
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




10 .     chlorogenic acid
C16H18O9     相似度:88.2%
Journal of Shenyang Pharmaceutical University          2009          26          188-190
Isolation, identification and activity determination on the anti-hypoxic components of Hypericum japonicum Thunb.
WANG Xiao-wei, MAO Yu, FAN Ming, DING A i-shi, WANG Nai-li, YAO Xin-sheng
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




11 .     chlorogenic acid
    相似度:88.2%
Journal of Shenyang Pharmaceutical University          2006          23          568-569
Chemical constituents from the water-soluble part of Notopterygium incisum Ting ex H. T. Chang
LIU Zhi-gang, REN Pei-pei, LI Fa-mei
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




12 .     5-O-caffeoylquinic acid methyl ester
C17H20O9     相似度:88.2%
Phytotherapy Research          1998          12          S164-S168
Constituents of Hypericum japonicum
Qing-Li Wu, Sheng-Ping Wang, Li-Jun Du, Li-Wei Wang, Jun-Shan Yang and Pei-Gen Xiao
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




13 .     chlorogenic acid
    相似度:88.2%
Phytotherapy Research          1998          12          562-567
Flavonol monoglycosides isolated from the antiviral fractions of Persea americana (Lauraceae) leaf infusion
A. P. de Almeida, M. M. F. S. Miranda, I. C. Simoni, M. D. Wigg, M. H. C. Lagrota and S. S. Costa
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




14 .     compound 1
    相似度:88.2%
Journal of Agricultural and Food Chemistry          1999          47          3963-3966
Phenolic Antioxidants from the Leaves of Corchorus olitorius L.
Keiko Azuma, Masayoshi Nakayama, Masaji Koshioka, Katsunari Ippoushi, Yuichi Yamaguchi, Katsunari Kohata, Yuji Yamauchi, Hidekazu Ito, and Hisao Higashio
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




15 .     3-caffeoylquinic acid methyl ester
    相似度:82.3%
Fitoterapia          2000          71          713-715
Constituents from Lonicera japonica
Li-Yan Peng, Shuang-Xi Mei, Bei Jiang, Hong Zhou,Han-Dong Sun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




16 .     3,5-dicaffeoylquinic acid
    相似度:82.3%
Fitoterapia          2000          71          713-715
Constituents from Lonicera japonica
Li-Yan Peng, Shuang-Xi Mei, Bei Jiang, Hong Zhou,Han-Dong Sun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




17 .     1S-3β-O-trans-caffeoyl-1α,4α,5β-trihydroxycyclohexane-1-carboxylic acid
C16H18O9     相似度:82.3%
Phytochemistry          1998          49          103-108
A Caffeoylcyclohexane-1-Carboxylic Acid Derivative From Asimina Triloba
Meena Haribal, Paul Feeny, Cathy C. Lester
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




18 .     chlorogenic acid
    相似度:82.3%
Korean Journal of Pharmacognosy          1998          29(2)          142-145
Phenolic Compound from Lepisorus thunbergianus
Lee, Min-Won
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




19 .     chlorogenic acid
C16H18O9     相似度:82.3%
Chinese Traditional and Herbal Drugs          2010          41          29-32
草珊瑚的化学成分研究
段营辉; 戴毅; 高昊; 叶文才; 姚新生;
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




20 .     绿原酸甲酯
    相似度:82.3%
Chinese Traditional and Herbal Drugs          2008          39          1635-1636+1720
灰毡毛忍冬的化学成分研究
贾晓东;冯煦;赵兴增;王鸣;孙浩;董云发
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




21 .     Chlorogenic acid
    相似度:82.3%
Archives of Pharmacal Research          1999          22          213-218
Antioxidant flavonoids and chlorogenic acid from the leaves of Eriobotrya japonica
Hyun Ah Jung, Jong Cheol Park, Hae Young Chung, Jong Kim and Jae Sue Choi
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




22 .     3-O-caffeoyl quinic acid methyl ester
    相似度:82.3%
Chinese Pharmaceutical Journal          2011          46          256-259
Study on Chemical Constituents of Codonopsis nervoa Chipp Nannf
FAN Qiang, ZHANG Yu, ZHOU Xian-li, GE Shang Suo Lang, HUANG Cong
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




23 .     methyl chlorogenate
    相似度:82.3%
Chinese Journal of Medicinal Chemistry          2010          20          214-216
Chemical constituents in the fruits of Xanthium sibiricum
QIU Yu-ling, DAI Ying-hui, WANG Dong, CUI Zheng
Structure      13C NMR   碳谱模拟图
艰难困苦,玉汝于成。
2楼2012-11-15 19:32:28
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