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小木虫论坛-学术科研互动平台 » 生物医药区 » 药学 » 求助微谱分子一个
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hdb6522

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[求助] 求助微谱分子一个 已有1人参与

碳谱:27.3,38.9,40.7,62.9,66.7,104.8,112.0,117.3,120.6,126.8,130.1,130.9,139.1,147.5,172.8
溶剂:甲醇
相似度:大于等于50%
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fly to sky
1楼 2014-04-28 16:26:02
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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
hdb6522: 金币+10, ★★★★★最佳答案 2014-05-01 08:15:18
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115个化合物(查询结果仅供参考)
1 .     2-[4-(Quinolin-2-ylamino)-phenyl]-ethanol
C17H16N2O     相似度:60%
Bioorganic & Medicinal Chemistry          2011          19          939-950
Microwave-assisted synthesis of quinoline, isoquinoline, quinoxaline and quinazoline derivatives as CB2 receptor agonists
Raimo Saari, Jonna-Carita Törmä, Tapio Nevalainen
Structure      13C NMR   碳谱模拟图
2 .     (E)-2-(4-(dimethylamino)styryl)quinazolin-4(3H)-one
C18H17N3O     相似度:60%
Journal of Heterocyclic Chemistry          2006          43          1057-1063
Convenient synthesis of some 2-substituted 4(3H)-quinazolinone derivatives
I. Philipova,G. Dobrikov,K. Krumova and J. Kaneti
Structure      13C NMR   碳谱模拟图
3 .     2-hydroxy-4-methyl-5-benzylacetophenone
    相似度:60%
Tetrahedron Letters          2002          43          6597-6600
Synthesis of ortho-hydroxyacetophenone derivatives from Baylis–Hillman acetates
Jae Nyoung Kim, Yang Jin Im, Jeong Mi Kim
Structure      13C NMR   碳谱模拟图
4 .     (E)-3-(2-(benzo[d][1,3]dioxol-5-yl)vinyl)benzenamine
C15H13O2N     相似度:60%
Bioorganic & Medicinal Chemistry          2010          18          5352-5366
Design, synthesis, and biological evaluation of resveratrol analogues as aromatase and quinone reductase 2 inhibitors for chemoprevention of cancer
Bin Sun, Juma Hoshino, Katie Jermihov, Laura Marler, John M. Pezzuto, Andrew D. Mesecar, Mark Cushman
Structure      13C NMR   碳谱模拟图
5 .     (S)-2-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
C13H14N2O4S     相似度:60%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图
6 .     (R)-2-(methylsulfonyl)-2,3,4,9-tetrahydro-1H-pyr-ido[3,4-b]indole-3-carboxylic acid
C13H14N2O4S     相似度:60%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图
7 .     chromene amide II
C17H23NO2     相似度:56.2%
Phytochemistry          1991          30          2677-2684
Chromene amides from Amyris texana
Gabriel de la Fuente, Matias Reina, Isabel Timon
Structure      13C NMR   碳谱模拟图
8 .     ethyl 2-(4-bromophenyl)-3-(4-methoxyphenyl)-3-methyl-butanoate
C20H23BrO3     相似度:56.2%
Tetrahedron          2013          69          7360-7364
Carbenoid insertions into benzylic C–H bonds with heterogeneous copper catalysts Original Research Article
José M. Fraile, José A. Mayoral, Ana Muñoz, Jorge Santafé-Valero
Structure      13C NMR   碳谱模拟图
9 .     methyl 5-((4-bromophenyl)amino)-3-(2,4-dichlorophenyl)-5-oxopentanoate
C18H16BrCl2NO3     相似度:56.2%
Bioorganic & Medicinal Chemistry          2014          22          1208-1217
Synthesis/biological evaluation of hydroxamic acids and their prodrugs as inhibitors for Botulinum neurotoxin A light chain
Hajime Seki, Sabine Pellett, Peter Šilhár, G. Neil Stowe, Beatriz Blanco, Matthew A. Lardy, Eric A. Johnson, Kim D. Janda
Structure      13C NMR   碳谱模拟图
10 .     compound 26
    相似度:56.2%
Journal of the American Chemical Society          1990          112          3475-3482
Stereoselective total syntheses of the antitumor antibiotics (+)-actinobolin and (-)-bactobolin from a common bridged lactone intermediate
Ravi S. Garigipati, David M. Tschaen, Steven M. Weinreb
Structure      13C NMR   碳谱模拟图
11 .     2-(2-bromophenyl)-2-(1H-indol-1-yl)pent-4-enenitrile
C19H17N2Br     相似度:55.5%
Organic Letters          2008          Vol.10,No.1          125-128
First Total Synthesis of Trimeric Indole Alkaloid, Psychotrimine

Structure      13C NMR   碳谱模拟图
12 .     lespeflorin G11
C25H26O5     相似度:53.3%
Journal of Natural Products          2009          72          194-203
Melanin Synthesis Inhibitors from Lespedeza floribunda
Maya Mori-Hongo,Hiroyuki Takimoto, Takayuki Katagiri, Makoto Kimura, Yu Ikeda, and Toshio Miyase
Structure      13C NMR   碳谱模拟图
13 .     tenucaulin A
C17H21NO3S     相似度:53.3%
Phytochemistry          2008          69          928-938
Amide-esters from Aglaia tenuicaulis – First representatives of a class of compounds structurally related to bisamides and flavaglines
Harald Greger, Margit Hofer, Klaus Teichmann, Johann Schinnerl,Caroline M. Pannell, Srunya Vajrodaya, Otmar Hofer
Structure      13C NMR   碳谱模拟图
14 .     2,2-dimethylchromene-6-propenoic acid
    相似度:53.3%
Journal of Natural Products          1998          61          896-900
Chemical Constituents of Brazilian Propolis and Their Cytotoxic Activities
Arjun H. Banskota, Yasuhiro Tezuka, Jeevan K. Prasain, Katsumichi Matsushige, Ikuo Saiki, and Shigetoshi Kadota
Structure      13C NMR   碳谱模拟图
15 .     3-Phenylaminopropionic acid 2-phenylsulfanyl-ethyl ester
C17H19NO2S     相似度:53.3%
Molecules          2009          14          4779-4789
Silica Sulfuric Acid Promotes Aza-Michael Addition Reactions under Solvent-Free Condition as a Heterogeneous and Reusable Catalyst
Yan Wang, Yan-Qin Yuan and Sheng-Rong Guo
Structure      13C NMR   碳谱模拟图
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Domyallbesttohaveahappylife.
2楼2014-04-28 20:26:36
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