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izzi

银虫 (小有名气)

[求助] 微谱求助查化合物

13C NMR (126 MHz, CDCl3) δ 11.96, 20.25, 20.31, 20.95, 23.25, 30.28, 34.05, 55.64, 60.83, 84.97, 102.15, 112.31, 114.67, 117.79, 129.73, 137.02, 142.11, 144.90, 145.35, 148.76, 170.31, 184.49, 193.91,197.28

13C NMR (126 MHz, CDCl3) δ 12.31, 12.80, 20.63, 26.91, 30.85, 35.66, 54.32, 56.73, 61.27, 64.67, 90.36, 102.62, 110.73, 110.83, 116.10, 117.63, 133.54, 142.86, 143.01, 144.90, 145.83, 147.34, 150.27, 185.72, 198.08
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小小笨笨虎

木虫 (正式写手)

【答案】应助回帖

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izzi: 金币+10, ★★★很有帮助 2013-04-20 23:55:33
查询结果:共查到4个化合物(查询结果仅供参考)  
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1 .     rotiorinol A acetate derivative
C25H28O6     相似度:52%
Journal of Natural Products          2006          69          891-895
Antifungal Azaphilones from the Fungus Chaetomium cupreum CC3003
Somdej Kanokmedhakul, Kwanjai Kanokmedhakul, Pitak Nasomjai, Sysavad Louangsysouphanh,Kasem Soytong, Minoru Isobe, Palangpon Kongsaeree, Samran Prabpai, and Apichart Suksamrarn
Structure      13C NMR   碳谱模拟图

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2 .     3-(3,4-dihydro-6-hydroxy-2,5,7,8-tetramethyl-2H-1-benzopyran-2-yl)-5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole
C23H26N2O5     相似度:52%
Bioorganic & Medicinal Chemistry          2010          18          3898-3909
Synthesis of a second generation chroman/catechol hybrids and evaluation of their activity in protecting neuronal cells from oxidative stress-induced cell death
Maria Koufaki, Elissavet Theodorou, Xanthippi Alexi, Michael N. Alexis
Structure      13C NMR   碳谱模拟图

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3 .     compound 2
C25H34N2O5Cl     相似度:52%
The Journal of Antibiotics          1999          52          160-170
Structure-specific Inhibition of Cholesteryl Ester Transfer Protein by Azaphilones
HIROSHI TOMODA, CHIKAKO MATSUSHIMA, NORIKO TABATA, ICHIJI NAMATAME, HARUO TANAKA, MARK J. BAMBERGER, HIROYUKI ARAI, MASAYOSHI FUKAZAWA, KEIZO INOUE, SATOSHI OMURA
Structure      13C NMR   碳谱模拟图

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4 .     lamellarin T
C30H27NO9     相似度:51.7%
Tetrahedron          1997          53          3457-3466
New lamellarin alkaloids from an unidentified ascidian from the Arabian Sea
M.Venkata Rami Reddy, D.John Faulkner, Y. Venkateswarlu, M.Rama Rao
Structure      13C NMR   碳谱模拟图

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3楼2013-04-17 23:14:48
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小小笨笨虎

木虫 (正式写手)

【答案】应助回帖

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感谢参与,应助指数 +1
izzi: 金币+20, ★★★很有帮助 2013-04-20 23:55:23
1.
查询结果:共查到8个化合物(查询结果仅供参考)  
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1 .     isochromophilone VI
C25H30NO6Cl     相似度:79.1%
Australian Journal of Chemistry          2003          56          13-15
Isochromophilone IX, a Novel GABA-Containing Metabolite Isolated from a Cultured Fungus, Penicillium sp.
Adam P. Michael, Emily J. Grace, Mike Kotiw and Russell A. Barrow
Structure      13C NMR   碳谱模拟图

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

2 .     isochromophilone IX
    相似度:68%
Australian Journal of Chemistry          2003          56          13-15
Isochromophilone IX, a Novel GABA-Containing Metabolite Isolated from a Cultured Fungus, Penicillium sp.
Adam P. Michael, Emily J. Grace, Mike Kotiw and Russell A. Barrow
Structure      13C NMR   碳谱模拟图

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

3 .     3-N-methylsclerotiorinamine
C22H26NO4Cl     相似度:66.6%
Journal of Natural Products          2000          63          1303-1305
8-O-Methylsclerotiorinamine, Antagonist of the Grb2-SH2 Domain, Isolated from Penicillium multicolor
Ji-Youn Nam,Hyae-Kyeong Kim,Ju-Young Kwon,Mi Young Han,Kwang-Hee Son,Un Chul Lee, Jung-Do Choi, and Byoung-Mog Kwon
Structure      13C NMR   碳谱模拟图

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

4 .     Isochromophilones X
C29H32ClNO4     相似度:62.0%
Natural Products and Bioprospecting          2012          2          117-120
Isochromophilones from an endophytic fungus Diaporthe sp.
Le-Yun Zang, Wei Wei, Ting Wang, Ye Guo, Ren-Xiang Tan, Hui-Ming Ge
Structure      13C NMR   碳谱模拟图

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5 .     3-(3-acetoxypropyl)-2-butyl-7-butyryloxy-5-chloro-7-methyl-2H,7H-isoquinoline-6,8-dione
C23H30ClNO6     相似度:54.1%
Journal of the American Chemical Society          2007          129          9860-9861
Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin
Sang Yeul Lee, Ryan C. Clark, and Dale L. Boger
Structure      13C NMR   碳谱模拟图

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

6 .     sclerotioramine
C21H24ClNO4     相似度:50%
Journal of Natural Products          2010          73          942-948
Chemical Epigenetics Alters the Secondary Metabolite Composition of Guttate Excreted by an Atlantic-Forest-Soil-Derived Penicillium citreonigrum
Xiaoru Wang, José G. Sena Filho, Ashley R. Hoover, Jarrod B. King, Trevor K. Ellis, Douglas R. Powell and Robert H. Cichewicz
Structure      13C NMR   碳谱模拟图

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

7 .     7-acetoxy-3-(3-acetoxypropyl)-2-benzyl-5-chloro-7-methyl-2H,7H-isoquinoline-6,8-dione
C24H24ClNO6     相似度:50%
Journal of the American Chemical Society          2007          129          9860-9861
Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin
Sang Yeul Lee, Ryan C. Clark, and Dale L. Boger
Structure      13C NMR   碳谱模拟图

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

8 .     7-acetoxy-2-benzyl-5-chloro-3-(3-hydroxypropyl)-7-methyl-2H,7H-isoquinoline-6,8-dione
C22H22ClNO5     相似度:50%
Journal of the American Chemical Society          2007          129          9860-9861
Total Synthesis, Stereochemical Reassignment, and Absolute Configuration of Chlorofusin
Sang Yeul Lee, Ryan C. Clark, and Dale L. Boger
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------
2楼2013-04-17 23:13:38
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nkx1979

木虫 (正式写手)

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感谢参与,应助指数 +1
izzi: 金币+10, ★★★很有帮助 2013-04-20 23:55:43
1 .     isochromophilone VI
C25H30NO6Cl     相似度:79.1%
Australian Journal of Chemistry          2003          56          13-15
Isochromophilone IX, a Novel GABA-Containing Metabolite Isolated from a Cultured Fungus, Penicillium sp.
Adam P. Michael, Emily J. Grace, Mike Kotiw and Russell A. Barrow
Structure      13C NMR   碳谱模拟图

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

2 .     isochromophilone IX
    相似度:68%
Australian Journal of Chemistry          2003          56          13-15
Isochromophilone IX, a Novel GABA-Containing Metabolite Isolated from a Cultured Fungus, Penicillium sp.
Adam P. Michael, Emily J. Grace, Mike Kotiw and Russell A. Barrow
Structure      13C NMR   碳谱模拟图

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

3 .     3-N-methylsclerotiorinamine
C22H26NO4Cl     相似度:66.6%
Journal of Natural Products          2000          63          1303-1305
8-O-Methylsclerotiorinamine, Antagonist of the Grb2-SH2 Domain, Isolated from Penicillium multicolor
Ji-Youn Nam,Hyae-Kyeong Kim,Ju-Young Kwon,Mi Young Han,Kwang-Hee Son,Un Chul Lee, Jung-Do Choi, and Byoung-Mog Kwon
Structure      13C NMR   碳谱模拟图
天道酬勤
4楼2013-04-18 07:08:15
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