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夏天的雪2359

铁杆木虫 (著名写手)

笨笨的小虫

[求助] 求助微谱数据

碳谱数据如下:
氘代氯仿:
27.8,27.9,28.0,28.0,29.5,30.4,39.1,55.1,55.5,59.2,104.7,107.2,110.6,112.6,113.7,114.1,118.3,118.9,119.5,120.2,121.5,122.1,124.6,128.7,129.0,134.2,135.9,141.4,143.9,145.8,166.9,167.6

非常感谢!
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wangkaibo123

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【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
夏天的雪2359: 金币+20, ★★★★★最佳答案, 谢谢! 2013-07-09 16:09:30
按从小到大顺序输入,数字间用英文半角逗号(,)分隔例如:
21.4,30.4,37.4,73.2,73.7,125.6,126.6,139.6,140.2,168.2

溶剂选项:
匹配容差: (数字格式,可自行设定)
相似度:   %(相似度>=50%)



查询结果:共查到117个化合物(查询结果仅供参考)
1 .     cyclo (N-(α,α-dimethylallyl)-L-trp-6a'-(α,α-dimethylallyl)-L-trp)
    相似度:71.8%
Bioscience, Biotechnology, and Biochemistry          1999          63          1910-1920
New Okaramine Congeners, Okamines J, K, L, M and Related Compounds, from Penicillium simplicissimum ATCC 90288
Yoshihito SHIONO, Kohki AKIYAMA, Hideo HAYASHI
Structure      13C NMR   碳谱模拟图
2 .     cyclo(N-(α,α-dimethylallyl)-L-trp-L-trp
    相似度:62.5%
Bioscience, Biotechnology, and Biochemistry          1999          63          1910-1920
New Okaramine Congeners, Okamines J, K, L, M and Related Compounds, from Penicillium simplicissimum ATCC 90288
Yoshihito SHIONO, Kohki AKIYAMA, Hideo HAYASHI
Structure      13C NMR   碳谱模拟图
3 .     nobilin E
C32H32O8     相似度:59.3%
Journal of Natural Products          2007          70          24-28
Bioactive Bibenzyl Derivatives and Fluorenones from Dendrobium nobile
Xue Zhang,Jie-Kun Xu,Jue Wang,Nai-Li Wang, Hiroshi Kurihara,Sumumu Kitanaka,and Xin-Sheng Yao
Structure      13C NMR   碳谱模拟图
4 .     2-(11-(4-(1H-indol-3-yl)-5,6-dihyropyridin-1(2H)-yl)undecyl)isoindoline-1,3-dione
    相似度:59.3%
Bioorganic & Medicinal Chemistry Letters          2007          17          5656-5660
Synthesis and characterization of a pegylated derivative of 3-(1,2,3,6-tetrahydro-pyridin-4yl)-1H-indole (IDT199): A high affinity SERT ligand for conjugation to quantum dots
Ian D. Tomlinson, Michael R. Warnerment, John N. Mason, Matthew J. Vergne, David M. Hercules, Randy D. Blakely, Sandra J. Rosenthal
Structure      13C NMR   碳谱模拟图
5 .     asterriquinone B1
    相似度:59.3%
The Journal of Antibiotics          2001          54          105-108
Short and Convergent Synthesis of Asterriquinone B1 and Demethylasterriquinone B1
KUNIAKI TATSUTA,HIROSHI MUKAI and KAZUKI MITSUMOTO
Structure      13C NMR   碳谱模拟图
6 .     compound 12
    相似度:59.3%
The Journal of Antibiotics          2001          54          105-108
Short and Convergent Synthesis of Asterriquinone B1 and Demethylasterriquinone B1
KUNIAKI TATSUTA,HIROSHI MUKAI and KAZUKI MITSUMOTO
Structure      13C NMR   碳谱模拟图
7 .     variecolorin L
    相似度:56.2%
Helvetica Chimica Acta          2008          Vol. 91          1888
Dioxopiperazine Alkaloids Produced by the Marine Mangrove Derived Endophytic Fungus Eurotium rubrum
Dong-Li Li, Xiao-Ming Li, Tie-Gang Li, Hong-Yue Dang, and Bin-Gui Wang
Structure      13C NMR   碳谱模拟图
8 .     terrequinone A
C32H30N2O3     相似度:56.2%
Journal of Natural Products          2004          67          1985-1991
Cytotoxic and Other Metabolites of Aspergillus Inhabiting the Rhizosphere of Sonoran Desert Plants1
Jian He, E. M. Kithsiri Wijeratne, Bharat P. Bashyal, Jixun Zhan, Christopher J. Seliga, Manping X. Liu, Elizabeth E. Pierson, Leland S. Pierson, Hans D. VanEtten, and A. A. Leslie Gunatilaka
Structure      13C NMR   碳谱模拟图
9 .     variecolorin L
C29H39N3O2     相似度:56.2%
Journal of Natural Products          2007          70          1558-1564
Isoechinulin-type Alkaloids, Variecolorins A–L, from Halotolerant Aspergillus Wariecolor
Wen-Liang Wang, Zhen-Yu Lu, Hong-Wen Tao, Tian-Jiao Zhu, Yu-Chun Fang, Qian-Qun Gu, and Wei-Ming Zhu
Structure      13C NMR   碳谱模拟图
10 .     (±)-picrasidine-F hydrochloride
C29H26N4O3     相似度:56.2%
Chemical & Pharmaceutical Bulletin          1986          34          3228-3236
Studies on the Alkaloids of Picrasma quassioides BENNET. VIII. : X-Ray Crystal Structure Analysis of Picrasidine-F
KAZUO KOIKE,TAICHI OHMOTO and KOREHARU OGATA
Structure      13C NMR   碳谱模拟图
11 .     quassidine B
C27H24N4O3     相似度:56.2%
Journal of Natural Products          2010          73          167-171
Quassidines A−D, Bis-β-carboline Alkaloids from the Stems of Picrasma quassioides
Wei-Hua Jiao, Hao Gao, Chen-Yang Li, Feng Zhao, Ren-Wang Jiang, Ying Wang, Guang-Xiong Zhou and Xin-Sheng Yao
Structure      13C NMR   碳谱模拟图
12 .     compound 29
    相似度:56.2%
Phytochemistry          1997          45          1235-1247
Bibenzyl derivatives from Pellia epiphylla
Frank Cullmann, Hans Becker, Enrique Pandolfi, Eckard Roeckner, Theophil Eicher
Structure      13C NMR   碳谱模拟图
13 .     Quassidine H
C28H26N4O4     相似度:56.2%
Chemical & Pharmaceutical Bulletin          2011          59(3)          359-364
Anti-inflammatory Alkaloids from the Stems of Picrasma quassioides BENNET
Wei-Hua JIAO, Hao GAO, Feng ZHAO, Hou-Wen LIN, Yu-Min PAN, Guang-Xiong ZHOU, and Xin-Sheng YAO
Structure      13C NMR   碳谱模拟图
14 .     okaramine G
    相似度:56.2%
Bioscience, Biotechnology, and Biochemistry          1998          62          804-806
Okaramine G, a New Okaramine Congener from Penicillium simplicissimum ATCC 90288
Hideo HAYASHI, Atsushi SAKAGUCHI
Structure      13C NMR   碳谱模拟图
15 .     okaramine J
C32H36N4O3     相似度:56.2%
Bioscience, Biotechnology, and Biochemistry          1999          63          1910-1920
New Okaramine Congeners, Okamines J, K, L, M and Related Compounds, from Penicillium simplicissimum ATCC 90288
Yoshihito SHIONO, Kohki AKIYAMA, Hideo HAYASHI
Structure      13C NMR   碳谱模拟图
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