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杨大松

至尊木虫 (文坛精英)

[求助] 求助微谱数据,谢谢

感觉是倍半萜,碳谱数据如下:
16.1,19.8,26.1,28.5,29.7,31.1,36.0,38.8,45.7,46.0,55.2,74.8,107.7,152.4
辛苦各位,非常感谢。
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kaola0916

铁杆木虫 (著名写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
karl2100: 金币+1, 谢谢! 2012-06-18 22:09:43
杨大松: 金币+15, ★★★★★最佳答案 2012-06-19 00:24:47
查询模式:模糊查询  
碳谱数据输入:
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
16.1,19.8,26.1,28.5,29.7,31.1,36.0,38.8,45.7,46.0,55.2,74.8,107.7,152.4
  
溶剂选项: 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值  
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278个化合物(查询结果仅供参考)  
--------------------------------------------------------------------------------

1 .     compound 5
C15H26O     相似度:100%
Journal of Natural Products          2003          66          1097-1100
A Novel 5-HT Receptor Ligand and Related Cytotoxic Compounds from an Acid Mine Waste Extremophile
Andrea A. Stierle, Donald B. Stierle, Eric Goldstein,Keith Parker,Tim Bugni, Chad Baarson,Julie Gress, and Danielle Blake
Structure      13C NMR   碳谱模拟图

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

2 .     rel-(1S,4S,SR,7R,10R)-10-Desmethyl-1-methyl-11-eudesmene
C15H26O     相似度:93.3%
Phytochemistry          1995          39          849-852
10-desmethyl-1-methyl-eudesmanes from Ocotea corymbosa
Juceni Pereira Chavez, Otto R. Gottlieb, Massayoshi Yoshida
Structure      13C NMR   碳谱模拟图

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

3 .     Pogostol
C15H28O3     相似度:93.3%
Journal of Natural Products          2012          75          798-801
Guaiane Sesquiterpenes from Biscogniauxia nummularia Featuring Potent Antigerminative Activity
Séverine Amand, Aude Langenfeld, Alain Blond, Joëlle Dupont, Bastien Nay, and Soizic Prado
Structure      13C NMR   碳谱模拟图

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

4 .     Pogostol
C15H28O3     相似度:86.6%
Journal of Natural Products          2012          75          798-801
Guaiane Sesquiterpenes from Biscogniauxia nummularia Featuring Potent Antigerminative Activity
Séverine Amand, Aude Langenfeld, Alain Blond, Joëlle Dupont, Bastien Nay, and Soizic Prado
Structure      13C NMR   碳谱模拟图

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

5 .     Xylaranol A
C15H26O2     相似度:73.3%
Helvetica Chimica Acta          2010          93          796-802
Four New Terpenoids from Xylaria sp. 101
Yao-Yao Li, Zhi-Yu Hu, Chun-Hua Lu and Yue-Mao Shen
Structure      13C NMR   碳谱模拟图

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

6 .     pogostol O-methyl ether
C16H28O     相似度:68.7%
Journal of Natural Products          1997          60          1054-1056
Pogostol O-Methyl Ether and Artabotrol: Two Novel Sesquiterpenes from the Stem Bark of Artabotrys stenopetalus
Theophilus C. Fleischer, Roger D. Waigh, and Peter G. Waterman
Structure      13C NMR   碳谱模拟图

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

7 .     5-epi-β-microbiotene
C15H24     相似度:66.6%
Indian Journal of Chemistry          2007          46B          805-817
Total synthesis of (±)-β-microbiotene,(±)-microbiotol,(±)-cyclocuparanol and (±)-β-cuparenones
Srikrishna,A; Ramachary,D B
Structure      13C NMR   碳谱模拟图

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

8 .     compound 6
C15H28O2     相似度:64.2%
Journal of Natural Products          2003          66          1097-1100
A Novel 5-HT Receptor Ligand and Related Cytotoxic Compounds from an Acid Mine Waste Extremophile
Andrea A. Stierle, Donald B. Stierle, Eric Goldstein,Keith Parker,Tim Bugni, Chad Baarson,Julie Gress, and Danielle Blake
Structure      13C NMR   碳谱模拟图

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

9 .     1-[(1S,2S,3R,4R)-2,3-Dimethylbicyclo[2.2.1]heptan-2-yl]-4-methylpent-2-en-1-one
C15H24O     相似度:64.2%
Chemistry & Biodiversity          2010          7          623-638
Synthesis of New exo- and endo-3,8-Dihydro-β-santalols and Other Norbornyl-Derived Alcohols
Agnès Muratore, Jean-Claude Clinet and Elisabet Duñach
Structure      13C NMR   碳谱模拟图

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

10 .     lepadiformine C
C16H29N     相似度:62.5%
Journal of Natural Products          2006          69(4)          558-562
Sensitivity of Cardiac Background Inward Rectifying K Outward Current (IK1) to the Alkaloids Lepadiformines A, B, and C
Martin-Pierre Sauviat, Joseph Vercauteren, Nicole Grimaud, Marcel Jug, Mohamed Nabil, Jean-Yves Petit, and Jean-Franois Biard
Structure      13C NMR   碳谱模拟图
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