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linwq

铁杆木虫 (著名写手)

[求助] 求助微谱数据库检索一化合物

91.85,104.50,109.96,116.95,119.22,121.21,121.45,126.13,129.47,131.30,
132.77,145.19,147.31,148.61,157.34,170.94

模糊查询,相似度大于60%
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kaola0916

铁杆木虫 (著名写手)

【答案】应助回帖

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感谢参与,应助指数 +1
linwq: 金币+10, ★★★★★最佳答案, 多谢了! 2012-05-16 20:27:19
查询结果:共查到15个化合物(查询结果仅供参考)  
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1 .     Compound 5e
    相似度:68.7%
Magnetic Resonance in Chemistry          2010          48          738-744
Synthesis and complete assignment of the 1H and 13C NMR signals of new acetamido and aminoflavonoid derivatives (pages 738–744)
Gilles Casano, Maxime Robin, Pascale Barbier, Vincent Peyrot and Robert Faure
Structure      13C NMR   碳谱模拟图

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2 .     (E)-(1-Benzotriazol-1-yl)-3,4,4-trichloro-1-(4-fluorophenylamino)-2-nitrobuta-1,3-diene
C16H10Cl3FN5O2     相似度:68.7%
Zeitschrift für Naturforschung B          2010          65          843-860
Chemistry of Polyhalogenated Nitrobutadienes, Part 9: Acyclic and Heterocyclic Nitroenamines and Nitroimines from 2-Nitroperchlorobuta-1,3-diene
V. A. Zapol'skii, J. C. Namyslo, M. Gjikaj, and D. E. Kaufmann
Structure      13C NMR   碳谱模拟图

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3 .     (E)-(1-Benzotriazol-1-yl)-3,4,4-trichloro-1-(4-ethoxyphenylamino)-2-nitrobuta-1,3-diene
C18H14Cl3N5O3     相似度:68.7%
Zeitschrift für Naturforschung B          2010          65          843-860
Chemistry of Polyhalogenated Nitrobutadienes, Part 9: Acyclic and Heterocyclic Nitroenamines and Nitroimines from 2-Nitroperchlorobuta-1,3-diene
V. A. Zapol'skii, J. C. Namyslo, M. Gjikaj, and D. E. Kaufmann
Structure      13C NMR   碳谱模拟图

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4 .     aristolochic acid A
C17H11NO7     相似度:64.7%
Chemical & Pharmaceutical Bulletin          2010          58          1093-1095
Two New Aristolochic Acid Derivatives from the Roots of Aristolochia fangchi and Their Cytotoxicities
Yu Cai and Tian-Ge Cai
Structure      13C NMR   碳谱模拟图

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5 .     3-acetylkaranjin
    相似度:63.1%
Organic Magnetic Resonance          1982          20          222-224
13C NMR studies of some complex natural oxygen heterocycles. V—13C NMR spectra of furanoflavones
S. C. Gupta, F. P. Singh, I. B. Cook and B. Ternai
Structure      13C NMR   碳谱模拟图

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6 .     heliannone A
C17H16O5     相似度:62.5%
Phytochemistry          1997          45          683-687
Bioactive flavonoids from Helianthus annuus cultivars
Francisco A. Macías, José M. G. Molinillo, Ascensión Torres, Rosa M. Varela, Diego Castellano
Structure      13C NMR   碳谱模拟图

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7 .     7,8-Dihydroxy-4-(3-hydroxy-4-methoxyphenyl)coumarin
    相似度:62.5%
Chemistry of Natural Compounds          2012          48          16-22
SYNTHESIS AND ANTIMICROBIAL ACTIVITIES OF 4-ARYL-3,4-DIHYDROCOUMARINS AND 4-ARYLCOUMARINS
Jie Sun,Wei-Xian Ding,Xiao-Ping Hong,Ke-Yun Zhang,and Yong Zou
Structure      13C NMR   碳谱模拟图

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8 .     5,7-Dibromo-1-[2-(3-bromophenyl)ethyl]-1H-indole-2,3-dione
C16H10NO2Br3     相似度:62.5%
Bioorganic & Medicinal Chemistry          2008          16          3118-3124
N-Phenethyl and N-naphthylmethyl isatins and analogues as in vitro cytotoxic agents
Lidia Matesic, Julie M. Locke, John B. Bremner, Stephen G. Pyne, Danielle Skropeta, Marie Ranson, Kara L. Vine
Structure      13C NMR   碳谱模拟图

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9 .     Compound 5b
    相似度:62.5%
Magnetic Resonance in Chemistry          2010          48          738-744
Synthesis and complete assignment of the 1H and 13C NMR signals of new acetamido and aminoflavonoid derivatives (pages 738–744)
Gilles Casano, Maxime Robin, Pascale Barbier, Vincent Peyrot and Robert Faure
Structure      13C NMR   碳谱模拟图

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

10 .     (E)-(1-Benzotriazol-1-yl)-3,4,4-trichloro-1-(4-iodophenylamino)-2-nitrobuta-1,3-diene
    相似度:62.5%
Zeitschrift für Naturforschung B          2010          65          843-860
Chemistry of Polyhalogenated Nitrobutadienes, Part 9: Acyclic and Heterocyclic Nitroenamines and Nitroimines from 2-Nitroperchlorobuta-1,3-diene
V. A. Zapol'skii, J. C. Namyslo, M. Gjikaj, and D. E. Kaufmann
Structure      13C NMR   碳谱模拟图

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

11 .     2-[(4-(cyanophenyl)ethynyl]-1H-indole-6-carbonitrile
C18H9N3     相似度:62.5%
Bioorganic & Medicinal Chemistry          2010          18          557-566
Synthesis, DNA binding, fluorescence measurements and antiparasitic activity of DAPI related diamidines
Abdelbasset A. Farahat, Arvind Kumar, Martial Say, Alaa El-Din M. Barghash, Fatma E. Goda, Hassan M. Eisa, Tanja Wenzler, Reto Brun, Yang Liu, Leah Mickelson, W. David Wilson, David W. Boykin
Structure      13C NMR   碳谱模拟图

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12 .     6-amino-2-(2-methoxyphenyl)-4H-chromen-4-one
C16H13NO3     相似度:62.5%
Bioorganic & Medicinal Chemistry          2010          18          6012-6023
Anti-HIV and antiplasmodial activity of original flavonoid derivatives
Gilles Casano, Aurélien Dumètre, Christophe Pannecouque, Sébastien Hutter, Nadine Azas, Maxime Robin
Structure      13C NMR   碳谱模拟图

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13 .     3-methoxy-2'',2''-dimethylpyrano[5'',6'':8,7]flavone
C17H10O3     相似度:62.5%
Natural Product Research and Development          2001          13(1)          1-4
STUDY ON THE CHEMICAL CONSTITUENTS OF THICKFRUIT MILLETTIA ROOT( MILLETTIA PACHYCARPA )
SHAO Wei yan; ZHU Ya fei; GUAN Shan yue; ZHONG Shi zhou; CHEN Feng ting
Structure      13C NMR   碳谱模拟图

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14 .     5,6,7,4'-tetrahydroxy-8-methoxyisoflavone
C16H12O7     相似度:62.5%
Journal of Integrative Plant Biology          2005          47          1404-1408
A New Isoflavonoid from Belamcanda chinensis (L.) DC.
Min-Jian QIN*, Wen-Liang JI, Zheng-Tao WANG and Wen-Cai YE
Structure      13C NMR   碳谱模拟图

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15 .     pongarotene
C18H10O4     相似度:61.1%
Natural Product Research          2002          16          351-357
Structure and Biological Activity of a New Rotenoid from Pongamia Pinnata
K. Simin; Zulfiqar Ali; Syed Muhammad Khaliq-Uz-Zaman; Viqar Uddin Ahmad
Structure      13C NMR   碳谱模拟图
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