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玉剑蓝

木虫 (正式写手)

[求助] 一个化合物求助微谱

氘代氯仿做谱
173.6,170.9,161.5,148.1,146.3,138.2,136.2,135.0,130.4,128.1,127.2,127.1,125.5,124.0,120.5,115.2,87.0,81.6,68.7,63.9,51.3,37.6,29.7,16.0
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玉剑蓝

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3楼: Originally posted by wangkaibo123 at 2013-06-30 16:44:07
  下回数据别反了

额 忘了,抱歉,多谢多谢~
4楼2013-06-30 16:47:08
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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
玉剑蓝: 金币+20, ★★★★★最佳答案 2013-06-30 16:47:19
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387个化合物(查询结果仅供参考)
1 .     Fumiquinazoline E
    相似度:72%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
2 .     3-Hydroxyfumiquinazoline A
    相似度:70.8%
Journal of Agricultural and Food Chemistry          2012          60          3424-3431
Metabolites from Aspergillus fumigatus, an Endophytic Fungus Associated with Melia azedarach, and Their Antifungal, Antifeedant, and Toxic Activities
Xiao-Jun Li, Qiang Zhang, An-Ling Zhang, and Jin-Ming Gao
Structure      13C NMR   碳谱模拟图
3 .     spiroquinazoline
    相似度:66.6%
Journal of Natural Products          2005          68          871-874
Discovery of New Natural Products by Application of X-hitting, a Novel Algorithm for Automated Comparison of Full UV Spectra,Combined with Structural Determination by NMR Spectroscopy
Thomas Ostenfeld Larsen, Bent O. Petersen, Jens . Duus,Dan Srensen, Jens C. Frisvad, and Michael E. Hansen
Structure      13C NMR   碳谱模拟图
4 .     fumiquinazolines A
C24H23N5O4     相似度:66.6%
China Journal of Chinese Materia Medica          2007          32          1848-1851
Study on Indole-Quinazolines Alkaloids from Marine-Derived Fungus Aspergillus sydowi PFW-13 and their Anti-Tumor Activities
ZHANG Min, FANG Yuchun, ZHU Tianjiao, ZHAO Wenying, GU Qianqun, HAN Xiaoxian, ZHU Weiming
Structure      13C NMR   碳谱模拟图
5 .     Fumiquinazoline A
C24H23N5O4     相似度:66.6%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
6 .     compound 4
    相似度:66.6%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
7 .     (-)-chaetominine
    相似度:66.6%
Chinese Pharmaceutical Journal          2011          46          1154-1158
Metabolites of Aspergillus sp. HT-2
ZHANG, Li-min, LI, Zhan-lina, BAI, Jiao, Wu, Xinc, WANG, Yu, HUA, Hui-ming
Structure      13C NMR   碳谱模拟图
8 .     Cottoquinazoline B
C23H19N5O4     相似度:62.5%
Organic Letters          2011          Vol.13,No.5          1130-1133
New Quinazolinone Alkaloids within Rare Amino Acid Residue from Coral-Associated Fungus, Aspergillus versicolor LCJ-5-4
Yibin Zhuang, Xiancun Teng, Yi Wang, Peipei Liu, Guoqiang Li, and Weiming Zhu
Structure      13C NMR   碳谱模拟图
9 .     Cottoquinazoline D
C24H19N5O4     相似度:62.5%
Organic Letters          2011          Vol.13,No.5          1130-1133
New Quinazolinone Alkaloids within Rare Amino Acid Residue from Coral-Associated Fungus, Aspergillus versicolor LCJ-5-4
Yibin Zhuang, Xiancun Teng, Yi Wang, Peipei Liu, Guoqiang Li, and Weiming Zhu
Structure      13C NMR   碳谱模拟图
10 .     Fumiquinazoline I
C27H29N5O4     相似度:59.2%
Chemistry-A European Journal          2000          6          1355-1360
Oxepinamides A-C and Fumiquinazolines H-I: Bioactive Metabolites from a Marine Isolate of a Fungus of the Genus Acremonium
Gilbert N. Belofsky, Montserrat Anguera, Paul R. Jensen, William Fenical and Matthias Köck
Structure      13C NMR   碳谱模拟图
11 .     Fumiquinazoline C
C24H21N5O4     相似度:58.3%
Chemistry of Natural Compounds          2005          41          236-238
ALKALOIDS FROM THE MARINE ISOLATE OF THE FUNGUS Aspergillus fumigatus
Sh. Sh. Afiyatullov, A. I. Kalinovskii, M. V. Pivkin,P. S. Dmitrenok, and T. A. Kuznetsova
Structure      13C NMR   碳谱模拟图
12 .     fumiquinazolines C
C24H21N5O4     相似度:58.3%
China Journal of Chinese Materia Medica          2007          32          1848-1851
Study on Indole-Quinazolines Alkaloids from Marine-Derived Fungus Aspergillus sydowi PFW-13 and their Anti-Tumor Activities
ZHANG Min, FANG Yuchun, ZHU Tianjiao, ZHAO Wenying, GU Qianqun, HAN Xiaoxian, ZHU Weiming
Structure      13C NMR   碳谱模拟图
13 .     spiroquinazoline
C23H19N5O3     相似度:58.3%
Journal of Natural Products          1994          Vol 57          471
Spiroquinazoline, a Novel Substance P Inhibitor with a New Carbon Skeleton, Isolated from Aspergillus flavipes
Colin J. Barrow, Hao H. Sun
Structure      13C NMR   碳谱模拟图
14 .     Chaetominine
C22H18N4O4     相似度:58.3%
Organic Letters          2006          8          5709-5712
Chaetominine, a Cytotoxic Alkaloid Produced by Endophytic Chaetomium sp. IFB-E015
Rui H. Jiao, Shu Xu,Jun Y. Liu, Hui M. Ge, Hui Ding, Chen Xu, Hai L. Zhu, and Ren X. Tan
Structure      13C NMR   碳谱模拟图
15 .     fumiquinazoline C
C24H21N5O4     相似度:58.3%
Chinese Pharmaceutical Journal          2011          46          569-575
Antitumor Metabolites from Fungus Aspergillus sydowi D2-6
REN Hong, CAO Xue-li, WANG Qiao-e, XV Chun-ming
Structure      13C NMR   碳谱模拟图
16 .     N-(4-Azabenzocyclobuten-1-yl)-N-[(1-hydroxy-2,5-divinylcyclopent-1-yl)methyl]-benzamide
C24H26N2O2     相似度:58.3%
Steroids          2012          77          157-167
Synthesis and characterization of (±)-13-hydroxy-3,11-diaza steroids
Malika Ibrahim-Ouali, Eugénie Romero
Structure      13C NMR   碳谱模拟图
17 .     Fumiquinazoline B
C24H23N5O4     相似度:58.3%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
18 .     Fumiquinazoline C
C24H21N5O4     相似度:58.3%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
19 .     2-[4-(3-methylbut-2-enyloxy)phenyl]-N'-(phthalazin-1-yl)cyclopropanecarbohydrazide
C23H24N4O2     相似度:58.3%
Bioorganic & Medicinal Chemistry          2010          18          2537-2548
Synthesis and anticancer activity evaluation of 2(4-alkoxyphenyl)cyclopropyl hydrazides and triazolo phthalazines
Prithwiraj De, Michel Baltas, Delphine Lamoral-Theys, Céline Bruyère, Robert Kiss, Florence Bedos-Belval, Nathalie Saffon
Structure      13C NMR   碳谱模拟图
20 .     1-phenylsulfonyl-1,3-dimethyl-5-((2-methyl-1H-indol-3-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
    相似度:58.3%
Indian Journal of Chemistry          2011          50B          843-857
Studies on Lewis-acid mediated domino reaction of N-protected bromomethylindoles with arenes/heteroarenes
Dhayalan, Vasudevan; Sureshbabu, Radhakrishnan; Mohanakrishnan, Arasambattu K
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
2楼2013-06-30 16:41:32
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wangkaibo123

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kerry

优秀版主

  下回数据别反了
Domyallbesttohaveahappylife.
3楼2013-06-30 16:44:07
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