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小木虫论坛-学术科研互动平台 » 生物医药区 » 药学 » 天然药物化学 » 2031微谱求助
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gaoaicai123

金虫 (小有名气)

[求助] 2031微谱求助

溶剂：DMSO
22.2,22.7,23.3,39.0,39.2,39.439.5,39.7,39.9,40.0,48.6,57.1,79.1,81.1,87.8,113.8,118.0,119.8,122.8,123.2,124.4,127.0,127.8,130.1,132.5,136.8,141.5,143.7,168.2,169.4
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1楼 2013-08-30 16:43:32
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wangkaibo123

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kerry

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【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
gaoaicai123: 金币+10 2013-08-31 10:11:01
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

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

格式不对
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Domyallbesttohaveahappylife.
2楼2013-08-30 19:22:37
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gaoaicai123

金虫 (小有名气)
引用回帖:
2楼: Originally posted by wangkaibo123 at 2013-08-30 19:22:37
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

溶剂选项：
匹配容差： (数字格式，可自行设定)
相似 ...

改正了，麻烦帮忙查一下，谢谢22.2,22.7,23.3,39.0,39.2,39.4,39.5,39.7,39.9,40.0,48.6,57.1,79.1,81.1,87.8,113.8,118.0,119.8,122.8,123.2,124.4,127.0,127.8,130.1,132.5,136.8,141.5,143.7,168.2,169.4
赞一下 回复此楼
3楼2013-08-30 20:31:37
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wangkaibo123

荣誉版主 (职业作家)

kerry

优秀版主

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★
gaoaicai123: 金币+10 2013-08-31 10:11:11
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

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17个化合物(查询结果仅供参考)
1 .     Asterrelenin
C25H25N3O4     相似度:76.6%
Journal of Natural Products          2005          68          1243-1246
Sesterterpenoids, Terretonins A−D, and an Alkaloid, Asterrelenin, from Aspergillus terreus
Guo-You Li, Bo-Gang Li, Tao Yang, Jian-Hua Yin, Hua-Yi Qi, Guang-Ye Liu, and Guo-Lin Zhang
Structure      13C NMR   碳谱模拟图
2 .     1-(5-O-[Bis(4-methylphenyl)(phenyl)methyl]-3-O-{(2-cyanoethoxy)[di(propan-2-yl)amino]phosphinyl}-2-deoxy-β-D-ribofuranosyl)-4-({[(9H-fluoren-9-yl)methoxycarbonyl]amino}methyl)-1H-1,2,3-triazole
C53H59N6O8P     相似度:59.3%
Chemistry & Biodiversity          2011          8          568-576
Simple and Stereoselective Preparation of an 4-(Aminomethyl)-1, 2, 3-triazolyl Nucleoside Phosphoramidite
Natalia A. Kolganova, Vladimir L. Florentiev, Alexander V. Chudinov, Alexander S. Zasedatelev and Edward N. Timofeev
Structure      13C NMR   碳谱模拟图
3 .     okaramine M
C29H30N4O3     相似度:56.6%
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
4 .     1-[3-((S)-1-Hydroxy-4-methyl-2-pentanylamino)-3-oxopropyl]-3-benzilbenzimidazolium Iodide
C23H29N3O2     相似度:56.6%
The Journal of Organic Chemistry          2012          77          4079-4086
Hydroxy-amide Functionalized Azolium Salts for Cu-Catalyzed Asymmetric Conjugate Addition: Stereocontrol Based on Ligand Structure and Copper Precatalyst
Naoatsu Shibata, Misato Yoshimura, Haruka Yamada, Ryuichi Arakawa, and Satoshi Sakaguchi
Structure      13C NMR   碳谱模拟图
5 .     N-(1-(3-Bromophenylamino)-4-cyanoisoquinolin-7-yl)-1H-indol-2-carboxamide
C25H16BrN5O     相似度:56.2%
Bioorganic & Medicinal Chemistry          2011          19          429-439
Synthesis and biological evaluation of 7-substituted-1-(3-bromophenylamino)isoquinoline-4-carbonitriles as inhibitors of myosin light chain kinase and epidermal growth factor receptor
Haridas B. Rode, Martin L. Sos, Christian Grütter, Stefanie Heynck, Jeffrey R. Simard, Daniel Rauh
Structure      13C NMR   碳谱模拟图
6 .     discarene C
C29H35N3O4     相似度:53.3%
Journal of Natural Products          2001          64          997-999
Cyclopeptides from the Bark of Discaria americana
Sandro R.Giacomelli,Fabiana C. Missau, Marco A. Mostardeiro, Ubiratan F. da Silva, Ionara I. Dalcol,Nilo Zanatta, and Ademir F. Morel
Structure      13C NMR   碳谱模拟图
7 .     carnosic acid γ-lactone 12-indoleacetate
C30H33NO4     相似度:53.3%
Journal of Natural Products          2010          73          639-643
Gastroprotective Effect of Carnosic Acid γ-Lactone Derivatives
Mariano Walter Pertino, Cristina Theoduloz, Jaime A. Rodríguez, Tania Yáñez, Viviana Lazo and Guillermo Schmeda-Hirschmann
Structure      13C NMR   碳谱模拟图
8 .     fructigenine A
C27H29N3O4     相似度:53.3%
Journal of Natural Products          1993          Vol 56          1707
Anacine, a New Benzodiazepine Metabolite of Penicillium aurantiogriseum Produced with Other Alkaloids in Submerged Fermentation
Jane M. Boyes-Korkis, Karen A. Gurney, Julia Penn, Peter G. Mantle, John N. Bilton, Richard N. Sheppard
Structure      13C NMR   碳谱模拟图
9 .     fructigenines A
C27H29N3     相似度:53.3%
Chinese Journal of Marine Drugs          2006          25(6)          1-6
Antitumor components from sponge-derived fungus Penicillium auratiogriseum Sp-19
XIN Zhi-hong, FANG Yu-chun, ZHU Tian-jiao, DUAN Lin, GU Qian-qun, ZHU Wei-ming
Structure      13C NMR   碳谱模拟图
10 .     1-{5-O-[Bis(4-methoxyphenyl)(phenyl)methyl]-2-deoxy-β-D-ribofuranosyl}-4-({[(9 H-fluoren-9-yl)-methoxycarbonyl]amino}methyl)-1H-1,2,3-triazole
C23H24N4O5     相似度:53.3%
Chemistry & Biodiversity          2011          8          568-576
Simple and Stereoselective Preparation of an 4-(Aminomethyl)-1, 2, 3-triazolyl Nucleoside Phosphoramidite
Natalia A. Kolganova, Vladimir L. Florentiev, Alexander V. Chudinov, Alexander S. Zasedatelev and Edward N. Timofeev
Structure      13C NMR   碳谱模拟图
11 .     schweinfurthin A
C34H44O6     相似度:50%
Journal of Natural Products          1998          61          1509-1512
Cytotoxic Geranyl Stilbenes from Macaranga schweinfurthii
John A. Beutler, Robert H. Shoemaker, Tanya Johnson, and Michael R. Boyd
Structure      13C NMR   碳谱模拟图
12 .     carnosic acid γ-lactone 12-phenylacetate
C28H32O4     相似度:50%
Journal of Natural Products          2010          73          639-643
Gastroprotective Effect of Carnosic Acid γ-Lactone Derivatives
Mariano Walter Pertino, Cristina Theoduloz, Jaime A. Rodríguez, Tania Yáñez, Viviana Lazo and Guillermo Schmeda-Hirschmann
Structure      13C NMR   碳谱模拟图
13 .     compound 6c
    相似度:50%
Indian Journal of Chemistry          2010          49B          107-111
A chemical strategy for the construction of quinoline isoquinoline core units
Pandey,V K; Tusi,S; Misra,R; Shukla,R
Structure      13C NMR   碳谱模拟图
14 .     2-(9,9'-dihexylfluorenyl )-3,4-diazafluorenone
C36H38N2O     相似度:50%
Heterocycles          2010          81          1157-1168
Synthesis of Diaza-Analogue of Fluorenone and Spirobifluorene
Guo-Hong Wu, Qian-Cai Liu, and Jie Tang
Structure      13C NMR   碳谱模拟图
15 .     LL-S490β
    相似度:50%
Tetrahedron letters          1982          23          225-228
Structure of aszonalenin, a new metabolite of aspergillus zonatus
Yasuo Kimura, Takashi Hamasaki, Hiromitsu Nakajima, Akira Isogai
Structure      13C NMR   碳谱模拟图
16 .     methyl 5-{2-[1-(2-acetylaminophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]ethyl}-1,4a-dimethyl-6-methylidenedecahydronaphthalene-1-carboxylate
C29H38N2O4     相似度:50%
Russian Journal of Organic Chemistry          2006          42          828-838
Synthetic transformations of higher terpenoids: XIV. Synthesis of pyrrololabdanoids from lambertianic acid
S. V. Chernov, E. E. Shul’ts, M. M. Shakirov and G. A. Tolstikov
Structure      13C NMR   碳谱模拟图
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Domyallbesttohaveahappylife.
4楼2013-08-30 20:44:23
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