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[求助]
求微谱查询一化合物结构
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| D2O作的碳谱：13.19,16.75,23.82,23.90,29.66,36.29,51.82,53.85,55.68,57.40,71.75,105.36,112.33,115.31,118.89,121.69,122.23,129.92,131.50,132.61,133.27,138.08,142.65,155.96,169.05 |
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wangkaibo123
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段青yu(豆哥代发): 金币+8, 谢谢 2013-10-22 08:42:39
感谢参与，应助指数 +1
段青yu(豆哥代发): 金币+8, 谢谢 2013-10-22 08:42:39
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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33个化合物(查询结果仅供参考) 1 . compound 3b 相似度:52% Chemical & Pharmaceutical Bulletin 1989 37 2053-2057 Marine Terpenes and Terpeoids. IX. : Structures of Six New Cembranoids, Sarcophytols F, K, P, Q, R and S, from the Soft Coral Sarcophyton glaucum Masaru KOBAYASHI,Takako IESAKA and Emiko NAKANO Structure 13C NMR 碳谱模拟图 2 . (+)-Streptophenazine E C22H24N2O5 相似度:52% Organic Letters 2011 Vol. 13, No. 20 5436-5439 The Revised Structure, Total Synthesis,and Absolute Configuration of Streptophenazine A Zhicai Yang, Xiaomin Jin, Michael Guaciaro, Bruce F. Molino, Ursula Mocek,Ricardo Reategui, Joshua Rhea, and Tim Morley Structure 13C NMR 碳谱模拟图 3 . (-)-Streptophenazine E C22H24N2O5 相似度:52% Organic Letters 2011 Vol. 13, No. 20 5436-5439 The Revised Structure, Total Synthesis,and Absolute Configuration of Streptophenazine A Zhicai Yang, Xiaomin Jin, Michael Guaciaro, Bruce F. Molino, Ursula Mocek,Ricardo Reategui, Joshua Rhea, and Tim Morley Structure 13C NMR 碳谱模拟图 4 . 2-((2-(Nitrooxy)ethyl)disulfanyl)ethyl-(2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetyl)-carbamate C24H24ClN3NaO8S2 相似度:52% Chemical & Pharmaceutical Bulletin 2012 60 465-481 NO-NSAIDs. Part 3: Nitric Oxide-Releasing Prodrugs of Non-steroidal Anti-inflammatory Drugs Namdev Borhade,Asif Rahimkhan Pathan,Somnath Halder,Manoj Karwa,Mini Dhiman,Venu Pamidiboina,Machhindra Gund,Jagannath Janardhan Deshattiwar,Sunil Vasantrao Mali,Nitin Janardanrao Deshmukh,Subrayan Palanisamy Senthilkumar,Parikshit Gaikwad,Santhosh Goud T Structure 13C NMR 碳谱模拟图 5 . compound 14 C27H37NO5S2 相似度:52% Heterocycles 2009 77 279-291 Benzothiazines in Organic Synthesis. An Approach to the Synthesis of seco-Pseudopteroxazole Michael Harmata and Pinguan Zheng Structure 13C NMR 碳谱模拟图 6 . akuammidine-N-oxide C21H24N2O4 相似度:52% Heterocycles 2009 79 1107-1112 Indole Alkaloids from the Leaves of Alstonia scholaris Yusuke Hirasawa, Saori Miyama, Nobuo Kawahara, Yukihiro Goda, Abdul Rahman, Wiwied Ekasari, Aty Widyawaruyanti, Gunawan Indrayanto, Noor Cholies Zaini, and Hiroshi Morita Structure 13C NMR 碳谱模拟图 7 . compound 28b C30H32N2O3 相似度:52% Heterocycles 2007 73 699-728 Multicomponent Synthesis of Novel 2-and 3-Substituted Dihydrobenzo[1, 4]oxazepinones and Tetrahydrobenzo[1, 4]diazepin-5-ones and Their Conformational Analysis Luca Banfi, Andrea Basso, Giuseppe Guanti, Paulina Lecinska, Renata Riva, and Valeria Rocca Structure 13C NMR 碳谱模拟图 8 . Compound 27 C28H32N4O3 相似度:52% Bioorganic & Medicinal Chemistry Letters 2006 16 5066-5072 Solid-phase synthesis and structure–activity relationships of novel biarylethers as melanin-concentrating hormone receptor-1 antagonists Vu Ma, Anthony W. Bannon, Jamie Baumgartner, Clarence Hale, Faye Hsieh, Christopher Hulme, Kirk Rorrer, John Salon, Carlo van Staden, Paul Tempest Structure 13C NMR 碳谱模拟图 9 . RID-B C34H43N2O2 相似度:52% Bioorganic & Medicinal Chemistry Letters 2007 17 2421-2424 Synthesis of the new pseudo-symmetrical tamoxifen derivatives and their anti-tumor activity Isamu Shiina, Yoshiyuki Sano, Kenya Nakata, Takaaki Kikuchi, Akane Sasaki, Masahiko Ikekita, Yoshimune Hasome Structure 13C NMR 碳谱模拟图 10 . 5-Methoxy-2-{N-[2-(2-methoxy-5-sulfamoyl)benzamido-ethyl]-N-n-propylamino}-tetralin hydrochloride C24H34N3O5S 相似度:52% Bioorganic & Medicinal Chemistry 1998 6 2111-2126 2-Aminotetralin-derived substituted benzamides with mixed dopamine D2, D3, and serotonin 5-HT1A receptor binding properties: A novel class of potential atypical antipsychotic agents Evert J. Homan, Swier Copinga, Lotta Elfström, Trees van der Veen, Jan-Pieter Hallema, Nina Mohell, Lena Unelius, Rolf Johansson, Håkan V. Wikström, Cor J. Grol Structure 13C NMR 碳谱模拟图 11 . 5-Methoxy-2-[N-(2-thiophen-2-carboxamidoethyl)-N-n-propylamino]tetralin hydrochloride C21H28N2O2S 相似度:52% Bioorganic & Medicinal Chemistry 1998 6 2111-2126 2-Aminotetralin-derived substituted benzamides with mixed dopamine D2, D3, and serotonin 5-HT1A receptor binding properties: A novel class of potential atypical antipsychotic agents Evert J. Homan, Swier Copinga, Lotta Elfström, Trees van der Veen, Jan-Pieter Hallema, Nina Mohell, Lena Unelius, Rolf Johansson, Håkan V. Wikström, Cor J. Grol Structure 13C NMR 碳谱模拟图 12 . 15-Chlorobenzylidene-14-deoxy-11,12-didehydro-andrographolide 相似度:52% Heterocycles 2011 83 1129-1137 Antifeedant Activities of Tutin and Andrographolide Derivatives against Mythimna separata Jun Cui, Meng-Lou Li,* Yan-Bing Zhang, and Fei-Fei Li Structure 13C NMR 碳谱模拟图 13 . N-(6-{[(3-chloro-4-methylanilino)carbonyl]amino}-2-methylquinolin-4-yl)-2-(4-methylpiperazin-1-yl)acetamide 25H29ClN6O2 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 203-221 Search for new pharmacophores for antimalarial activity. Part I: Synthesis and antimalarial activity of new 2-methyl-6-ureido-4-quinolinamides S. Madapa, Z. Tusi, D. Sridhar, A. Kumar, M.I. Siddiqi, K. Srivastava, A. Rizvi, R. Tripathi, S.K. Puri, G.B. Shiva Keshava, P.K. Shukla, S. Batra Structure 13C NMR 碳谱模拟图 14 . compound 7 C21H32O4 相似度:52% Tetrahedron 1995 51 11111-11118 New xenia diterpenoids from a soft coral, xenia species 1 Tetsuo Iwagawa, Yasuhisa Amano, Tsunao Hase, Motoo Shiro Structure 13C NMR 碳谱模拟图 15 . methyl 2,6-bis(4-bromophenyl)-1-(4-chlorophenyl)-4-(4-chlorophenylamino)-1,2,5,6-tetrahydropyridine-3-carboxylate C31H24Br2Cl2N2O2 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 625-633 Organocatalyzed highly atom economic one pot synthesis of tetrahydropyridines as antimalarials Mridul Misra, Swaroop Kumar Pandey, Vivek Parashar Pandey, Jyoti Pandey, Renu Tripathi, Rama Pati Tripathi Structure 13C NMR 碳谱模拟图 16 . methyl 2,6-bis(4-bromophenyl)-1-phenyl-4-(phenylamino)-1,2,5,6-tetrahydropyridine-3-carboxylate C31H26N2O2Br2 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 625-633 Organocatalyzed highly atom economic one pot synthesis of tetrahydropyridines as antimalarials Mridul Misra, Swaroop Kumar Pandey, Vivek Parashar Pandey, Jyoti Pandey, Renu Tripathi, Rama Pati Tripathi Structure 13C NMR 碳谱模拟图 17 . methyl-(4-chlorophenyl)-4-(4-chlorophenylamino)-2,6-bis(methoxyphenyl)-1,2,5,6-tetrahydropyridine-3-carboxylate C33H30N2O4Cl2 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 625-633 Organocatalyzed highly atom economic one pot synthesis of tetrahydropyridines as antimalarials Mridul Misra, Swaroop Kumar Pandey, Vivek Parashar Pandey, Jyoti Pandey, Renu Tripathi, Rama Pati Tripathi Structure 13C NMR 碳谱模拟图 18 . N-(4-amino-2,6-diisopropylphenyl)-N'-{[4-(3-methoxyphenyl)-1-(4-methoxyphenyl)piperidin-4-yl]methyl}urea dihydrochloride C33H44N4O3 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 4636-4646 Synthesis and structure–activity relationships of N-(4-amino-2,6-diisopropylphenyl)-N’-(1,4-diarylpiperidine-4-yl)methylureas as anti-hyperlipidemic agents Shigehiro Asano, Hitoshi Ban, Koichi Kino, Katsuhisa Ioriya, Masami Muraoka Structure 13C NMR 碳谱模拟图 19 . glibenclamidemetabolite 4-[(Nitrooxy)methyl]benzoate C31H33ClN4SO10 相似度:52% Bioorganic & Medicinal Chemistry 2009 17 5426-5432 NO-glibenclamide derivatives: Prototypes of a new class of nitric oxide-releasing anti-diabetic drugs Vincenzo Calderone, Simona Rapposelli, Alma Martelli, Maria Digiacomo, Lara Testai, Scilla Torri, Piero Marchetti, Maria C. Breschi, Aldo Balsamo Structure 13C NMR 碳谱模拟图 20 . (6bS,7R,8S)-4,9-dihydroxy-7,8-dimethoxy-1,6b,7,8-tetrahydro-2H-benzo[j]fluoranthen-3-one C22H20O5 相似度:52% The Journal of Antibiotics 2001 54 479-488 Novel Reduced Benzo[j]fluoranthen-3-ones from Cladosporium cf. cladosporioides with Cytokine Production and Tyrosine Kinase Inhibitory Properties STEPHEN K. WRIGLEY,A. MARTYN AINSWORTH,DAVID A. KAU,STEVEN M. MARTIN,SANGEETA BAHL,JENNY S. TANG,DAVID J. HARDICK,PHILIP RAWLINS,ROYA SADHEGHI and MICHAEL MOORE Structure 13C NMR 碳谱模拟图 |
2楼2013-10-17 11:55:05