24小时热门版块排行榜    

查看: 410  |  回复: 2
当前只显示满足指定条件的回帖,点击这里查看本话题的所有回帖

namujila

金虫 (正式写手)

[求助] 维谱查新求助

求助维谱查13C NMR (125 MHz, CDCl3) δ103.81, 107.78, 114.56, 120.25,128.58, 129.03, 130.76, 132.06, 134.75, 144.70,162.66,166.47,192.02
回复此楼
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

guozhiyong

银虫 (小有名气)

【答案】应助回帖

★ ★ ★ ★ ★
namujila: 金币+5, ★★★★★最佳答案 2013-05-02 16:14:44
1 .     4-Fluoro-2',4'-dihydroxychalcone
C15H11FO3     相似度:69.2%
Bioorganic & Medicinal Chemistry          2012          20          25-33
Solid-phase synthesis of 20-hydroxychalcones. Effects on cell growth inhibition, cell cycle and apoptosis of human tumor cell lines
Marta Perro Neves, Sara Cravo, Raquel T. Lima,M. Helena Vasconcelos,M. São José Nascimento, Artur M.S. Silva, Madalena Pinto, Honorina Cidade, Arlene G. Corrêa
Structure      13C NMR   碳谱模拟图

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

2 .     (Z)-3-(1-benzylidene)phthalide
    相似度:69.2%
Heterocycles          2007          74          819-825
Theoretical Studies of 5-exo Selective Intramolecular Cyclization of O-Alkynylbenzoic Acid Catalyzed by Organic Base
Masahiro Terada, Chikashi Kanazawa, and Masahiro Yamanaka
Structure      13C NMR   碳谱模拟图

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

3 .     2'-hydroxy-4'-methoxychalcone
    相似度:68.7%
Journal of Natural Products          1997          60          65-68
Resorcinol Derivatives and Flavonoids of Ononis natrix Subspecies ramosissima
Alejandro F. Barrero, M. Mar Herrador, Pilar Arteaga, Ignacio Rodríguez-García, and Manuel García-Moreno
Structure      13C NMR   碳谱模拟图

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

4 .     2'-hydroxy-4'-methoxychalcone
    相似度:68.7%
Natural Product Research and Development          2009          21          246-248
Study on the Chemical Constituents of Oxytropis falcata Bunge
YAN Hai-yan; GAO Li-ming
Structure      13C NMR   碳谱模拟图

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

5 .     (E)-1-[4-(allyloxy)-2-hydroxyphenyl]-3-phenylprop-2-en-1-one
C18H16O3     相似度:68.7%
Bioorganic & Medicinal Chemistry          2011          19          7711-7719
Structure–activity relationships of chalcone analogs as potential inhibitors of ADP- and collagen-induced platelet aggregation
M. Vijaya Bhaskar Reddy, Wei-Jern Tsai, Keduo Qian, Kuo-Hsiung Lee, Tian-Shung Wu
Structure      13C NMR   碳谱模拟图

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

6 .     2',4'-Dihydroxy-3,4,5-trimethoxychalcone
C18H18O6     相似度:66.6%
Bioorganic & Medicinal Chemistry          2012          20          25-33
Solid-phase synthesis of 20-hydroxychalcones. Effects on cell growth inhibition, cell cycle and apoptosis of human tumor cell lines
Marta Perro Neves, Sara Cravo, Raquel T. Lima,M. Helena Vasconcelos,M. São José Nascimento, Artur M.S. Silva, Madalena Pinto, Honorina Cidade, Arlene G. Corrêa
Structure      13C NMR   碳谱模拟图

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

7 .     (2E)-1-[4-(4-azidobutoxy)-2-hydroxyphenyl]-3-phenylprop-2-en-1-one
C19H19N3O3     相似度:64.7%
Molecules          2012          17          10331-10343
Design and Synthesis of New Chacones Substituted with Azide/Triazole Groups and Analysis of Their Cytotoxicity Towards HeLa Cells
Graziele D. da Silva, Marina G. da Silva, Estrela M. P. V. E. Souza, Andersson Barison, Sarah C. Simões, Fernando P. Varotti, Leandro A. Barbosa, Gustavo H. R. Viana and José A. F. P. Villar
Structure      13C NMR   碳谱模拟图

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

8 .     3,5-Bis[(2-formylphenoxy)methyl]-2,6-diphenyl-4H-pyran-4-one
C33H24O6     相似度:64.2%
Molecules          2000          5          200-207
Chemistry of Pyrones, Part 3: New Podands of 4H-Pyran-4-ones
Aziz Shahrisa and Alireza Banaei
Structure      13C NMR   碳谱模拟图

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

9 .     (4-fluorophenyl)-quinolin-2-yl-methanone
C16H10FNO     相似度:64.2%
Bioorganic & Medicinal Chemistry          2009          17          4441-4447
Synthesis of quinolinyl and isoquinolinyl phenyl ketones as novel agonists for the cannabinoid CB2 receptor
Bastien Reux, Tapio Nevalainen, Katri H. Raitio, Ari M.P. Koskinen
Structure      13C NMR   碳谱模拟图

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

10 .     2'-Hydroxy-4'-methoxychalcone
    相似度:62.5%
Australian Journal of Chemistry          1981          34          1779-1784
The constituents of Australian Pimelea species. II. The isolation of unusual flavones from P. simplex and P. decora
PW Freeman, ST Murphy, JE Nemorin and WC Taylor
Structure      13C NMR   碳谱模拟图

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

11 .     1H-indole-5-carbaldehyde
C9H7NO     相似度:61.5%
Natural Product Research          2004          18          253-258
Prenylindoles from Tanzanian Monodora and Isolona Species
Mayunga H. H. Nkunya; John J. Makangara; Stephan A. Jonker
Structure      13C NMR   碳谱模拟图

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

12 .     4-(1H-Imidazol-1yl)-6-(4-methoxyphenyl)pyrimidine
C14H12N4O     相似度:61.5%
Molecules          2011          16          5550-5560
An Electrochemical Synthesis of Functionalized Arylpyrimidines from 4-Amino-6-Chloropyrimidines and Aryl Halides
Stéphane Sengmany, Erwan Le Gall and Eric Léonel
Structure      13C NMR   碳谱模拟图

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

13 .     Benzylidene-1-(4-fluorophenyl)-2,2,2-trifluoroethylamine
C15H11F4N     相似度:61.5%
Tetrahedron Letters          2012          53          607-611
Thermocontrolled benzylimine-benzaldimine rearrangement over Nafion-H catalysts for efficient entry into α-trifluoromethylbenzylamines
G.K. Surya Prakash,Kevin E. Glinton,Chiradeep Panja,Laxman Gurung,Patrice T. Battamack,Béla Török,Thomas Mathew,George A. Olah
Structure      13C NMR   碳谱模拟图

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

14 .     2-(p-chlorophenyl)-5-((styrylsulfonyl)methyl)-1,3,4-thiadiazole
    相似度:61.5%
Chemical & Pharmaceutical Bulletin          2009          57          1376-1380
Synthesis, Antimicrobial and Antioxidant Activities of Sulfone Linked Bis Heterocycles—Pyrazolyl Oxadiazoles and Pyrazolyl Thiadiazole
Venkatapuram Padmavathi, Sanapalli Nagi Reddy and Konda Mahesh
Structure      13C NMR   碳谱模拟图

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

15 .     5-hydroxy-3-phenyl-4-thioxo-3,4-dihydro-2H-1,3-benzoxa-zin-2-one
C14H9NO3S     相似度:61.5%
Journal of Heterocyclic Chemistry          2009          46          873-880
Synthesis and antifungal evaluation of hydroxy-3-phenyl-2H-1,3-benzoxazine-2,4(3H)-diones and their thioanalogs
Pavel Skála,Miloš Macháček,Marcela Vejsová,Lenka Kubicová,Jiří Kuneš and Karel Waisser
Structure      13C NMR   碳谱模拟图

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

16 .     5-hydroxy-3-(4-methylphenyl)-4-thioxo-3,4-dihydro-2H-1,3-benzoxazin-2-one
C15H11NO3S     相似度:61.5%
Journal of Heterocyclic Chemistry          2009          46          873-880
Synthesis and antifungal evaluation of hydroxy-3-phenyl-2H-1,3-benzoxazine-2,4(3H)-diones and their thioanalogs
Pavel Skála,Miloš Macháček,Marcela Vejsová,Lenka Kubicová,Jiří Kuneš and Karel Waisser
Structure      13C NMR   碳谱模拟图

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

17 .     3-(4-chlorophenyl)-5-hydroxy-4-thioxo-3,4-dihydro-2H-1,3-benzoxazin-2-one
C14H8ClNO3S     相似度:61.5%
Journal of Heterocyclic Chemistry          2009          46          873-880
Synthesis and antifungal evaluation of hydroxy-3-phenyl-2H-1,3-benzoxazine-2,4(3H)-diones and their thioanalogs
Pavel Skála,Miloš Macháček,Marcela Vejsová,Lenka Kubicová,Jiří Kuneš and Karel Waisser
Structure      13C NMR   碳谱模拟图

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

18 .     methyl 3-(phenylthio)thiophene-2-carboxylate
C12H10O2S2     相似度:61.5%
Heterocycles          2007          72          697-708
Regioselective Synthesis of Methyl 3-Thiothiophene-2-carboxylate Derivatives Utilizing a Dehydration-Type Ti-Dieckmann Condensation
Ryohei Nagase, Hideki Gotoh, Mayumi Katayama, Naoki Manta, and Yoo Tanabe
Structure      13C NMR   碳谱模拟图

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

19 .     4,2',4'-羟基查尔酮
    相似度:61.5%
Journal of Shenyang Pharmaceutical University          2007          24          23-25
Chemical constituents of Astragalus membranaceus Bge. var. mongholicus(Bge.) Hsiao
LI Rui-fen, ZHOU Yu-zhi, QIAO Li, FU Hong-wei, PEI Yue-hu
Structure      13C NMR   碳谱模拟图

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

20 .     Methyl 4-(o-nitrobenzyloxy)benzoate
    相似度:61.5%
Bioorganic & Medicinal Chemistry          1996          4          1455-1470
Synthesis of complex δ-acetylenic amino acids as potential multisubstrate adduct inhibitors of methyltransferases
Mark R. Burns, James K. Coward
Structure      13C NMR   碳谱模拟图

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

21 .     2-Amino-4-methoxy-6-phenyl-5-(3-thienyl)pyrimidine
C15H13N3OS     相似度:61.5%
Bioorganic & Medicinal Chemistry          2000          8          739-750
Structural studies on bioactive compounds. Part 29: Palladium catalysed arylations and alkynylations of sterically hindered immunomodulatory 2-amino-5-halo-4,6-(disubstituted)pyrimidines
Duncan R. Hannah, Edward C. Sherer, Roy V. Davies, Roger B. Titman, Charles A. Laughton, Malcolm F.G. Stevens
Structure      13C NMR   碳谱模拟图

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

22 .     compound 3d
C16H8F4S     相似度:61.5%
Tetrahedron          2012          68          4233-4241
Regioselective C–S bond formation accomplished by copper-catalyzed regioselective C–F substitution of perfluoroarenes with aryl thioacetates or benzyl thioacetate
Qizhong Zhou, Bin Zhang, Tieqi Du, Haining Gu, Huajiang Jiang, Rener Chen
Structure      13C NMR   碳谱模拟图

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

23 .     4-(Benzofuran-2-yl)phenol
    相似度:61.5%
Bioorganic & Medicinal Chemistry          2012          20          3038-3048
Inhibition of cholinesterase activity and amyloid aggregation by berberine-phenyl-benzoheterocyclic and tacrine-phenyl-benzoheterocyclic hybrids
Ling Huang, Tao Su, Wenjun Shan, Zonghua Luo, Yang Sun, Feng He, Xingshu Li
Structure      13C NMR   碳谱模拟图

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

24 .     (E)-1-(4-methoxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
    相似度:61.5%
Bioorganic & Medicinal Chemistry          2009          17          6780-6785
Solution-phase parallel synthesis of substituted chalcones and their antiparasitary activity against Giardia lamblia
Julio Montes-Avila, Sylvia P. Díaz-Camacho, Josefina Sicairos-Félix, Francisco Delgado-Vargas, I.A. Rivero
Structure      13C NMR   碳谱模拟图

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

25 .     2-((1E,3E)-4-(3-fluorophenyl)buta-1,3-dien-1-yl)isoindoline-1,3-dione
C18H12FNO2     相似度:61.5%
Tetrahedron          2012          68          3545-3551
Highly stereoselective synthesis of N-substituted π-conjugated phthalimides
Piotr Pawluć, Adrian Franczyk, Jędrzej Walkowiak, Grzegorz Hreczycho, Maciej Kubicki, Bogdan Marciniec
Structure      13C NMR   碳谱模拟图

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

26 .     1-hydroxyphenazine
    相似度:61.5%
Journal of Medicinal Chemistry          2010          53          8688-8699
Potential Chemopreventive Agents Based on the Structure of the Lead Compound 2-Bromo-1-hydroxyphenazine, Isolated from Streptomyces Species, Strain CNS284
Martin Conda-Sheridan, Laura Marler, Eun-Jung Park, Tamara P. Kondratyuk, Katherine Jermihov, Andrew D. Mesecar, John M. Pezzuto, Ratnakar N. Asolkar, William Fenical, and Mark Cushman
Structure      13C NMR   碳谱模拟图

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

27 .     p-hydroxycinnamyl benzoate
    相似度:61.5%
Tetrahedron          2012          68          9068-9075
Organocatalytic selective benzoylation of alcohols with trichloromethyl phenyl ketone: inverse selectivity in benzoylation of alcohols containing phenol or aromatic amine functionality
Ram N. Ram, Vineet Kumar Soni, Dharmendra Kumar Gupta
Structure      13C NMR   碳谱模拟图

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

28 .     guignardianone C
C15H16O5     相似度:61.5%
Phytochemistry          2013          89          96-103
Phytotoxic dioxolanone-type secondary metabolites from Guignardia bidwellii
Iris Buckel, Daniel Molitor, Johannes C. Liermann, Louis P. Sandjo, Beate Berkelmann-Löhnertz, Till Opatz, Eckhard Thines
Structure      13C NMR   碳谱模拟图

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

29 .     isoliquiritigenin
C15H12O4     相似度:61.5%
Archives of Pharmacal Research          2011          34          881-886
A New Phenolic Compound with Anticancer Activity from the Wood of Millettia leucantha
Kanok-on Rayanil, Pastraporn Bunchornmaspan, and Pittaya Tuntiwachwuttikul
Structure      13C NMR   碳谱模拟图

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

30 .     2-(1H-Pyrazol-1-yl)-6-(2-thienyl) 4-trifluoromethylpyrimidine
C12H7F3N4S     相似度:61.5%
Journal of the Brazilian Chemical Society          2007          18          1316-1321
Synthesis of 6-(2-Furyl) and 6-(2-Thienyl)-4-trifluoromethylpyrimidinones and -pyrimidines from 4-(2-Heteroaryl)-4-methoxy-1,1,1-trifluoro-3-buten-2-ones
Alex F. C. Flores, Lucas Pizzuti, Sergio Brondani, Marcelo Rossato, Nilo Zanatta and Marcos A. P. Martins
Structure      13C NMR   碳谱模拟图

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

31 .     compound 7a
    相似度:61.5%
Journal of the Brazilian Chemical Society          1998          9          119-130
Synthesis of new 1,2 Benzothiazin One Derivatives Designed as Dual Cyclooxygenase 2 and 5 Lipooxygenase Inhibitors.
Lis Helena P. Teixeira, Carlos A.M. Fraga, and Eliezer J. Barreiro
Structure      13C NMR   碳谱模拟图

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

32 .     (Z)-3-(4-Chlorobenzylidene)isobenzofuran-1-one
C15H9ClO2     相似度:61.5%
Molecules          2013          18          3479-3501
Synthesis, Bioevaluation and Structural Study of Substituted Phthalazin-1(2H)-ones Acting as Antifungal Agents
Marcos Derita, Esther del Olmo, Bianca Barboza, Ana Esther García-Cadenas, José Luis López-Pérez, Sebastián Andújar, Daniel Enriz, Susana Zacchino and Arturo San Feliciano
Structure      13C NMR   碳谱模拟图

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

33 .     2',4'-dihydroxychalcone
    相似度:60%
Journal of Natural Products          1997          60          65-68
Resorcinol Derivatives and Flavonoids of Ononis natrix Subspecies ramosissima
Alejandro F. Barrero, M. Mar Herrador, Pilar Arteaga, Ignacio Rodríguez-García, and Manuel García-Moreno
Structure      13C NMR   碳谱模拟图

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

34 .     2-Bromo-3-(3-fluorophenyl)-1H-inden-1-one
C15H8BrFO     相似度:60%
Helvetica Chimica Acta          2012          95          469-482
Regioselective Arylation and Alkynylation of 2,3-Dibromo-1H-inden-1-one by Suzuki-Miyaura and Sonogashira Cross-Coupling Reactions
Rasheed Ahmad Khera, Munawar Hussain,Nguyen Thai Hung, Nadi Eleya,Holger Feist,Alexander Villinger, and Peter Langer
Structure      13C NMR   碳谱模拟图

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

35 .     isoquiritigenin
    相似度:60%
Journal of Shenyang Pharmaceutical University          2006          23          10-12
Chemical constituents from Myristica fragrans Houtt
LI Xiu-fang, WU Li-jun, JIA Tian-zhu, YUAN Zi-min, GAO Hui-yuan
Structure      13C NMR   碳谱模拟图

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

36 .     (2Z,4Z)-methyl-5-chloro-2-((4-chlorophenylthio)methyl)-5-(4-fluorophenyl)penta-2,4-dienoate
C19H15Cl2FO2S     相似度:60%
Heterocycles          2012          85          43-56
Unexpected Tandem Reaction of New Type Morita-Baylis-Hillman Adducts Promoted by [Hmim]HSO4/NaNO3 System
Weihui Zhong,* Guan Wang, and Kai Chen
Structure      13C NMR   碳谱模拟图

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

37 .     2'-Hydroxy-3',4'-dimethoxychalcone
    相似度:60%
Phytochemistry          2012          81          126-132
Propolis with high flavonoid content collected by honey bees from Acacia paradoxa
Van H. Tran, Rujee K. Duke, Abdallah Abu-Mellal, Colin C. Duke
Structure      13C NMR   碳谱模拟图
3楼2013-05-02 14:47:36
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
查看全部 3 个回答

guozhiyong

银虫 (小有名气)

【答案】应助回帖

感谢参与,应助指数 +1
没有相关的化合物,用模糊搜索,有455个化合物,但是没有相似度很高的,最高只有66%!祝你好运!
2楼2013-05-02 14:44:29
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
信息提示
请填处理意见