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[求助]
求助几个化合物的微谱数据
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化合物1： 23.21 ,32.09 ,34.22 ,50.31 ,51.26 ,52.46 ,55.31 ,65.49 ,94.96 ,103.40 ,107.60 ,112.21 ,112.51 ,117.22 ,128.90 ,133.17 ,135.37 ,140.73 ,149.05 ,151.55 ,171.96 化合物2： 17.55 ,17.78 ,17.83 ,18.10 ,19.11 ,21.76 ,24.32 ,24.56 ,25.56 ,29.37 ,32.01 ,33.96 ,38.36 ,39.27 ,40.57 ,40.64 ,41.00 ,42.51 ,42.65 ,43.57 ,44.31 ,54.63 ,67.37 ,71.47 ,78.87 ,126.71 ,140.10 化合物3： 14.60 ,20.70 ,21.55 ,24.51 ,27.89 ,30.70 ,37.00 ,40.48 ,53.60 ,54.50 ,54.71 ,59.93 ,61.79 ,72.42 ,83.76 ,110.05 ,111.99 ,119.00 ,120.16 ,123.02 ,137.94 ,174.80 化合物4： 25.54,25.69,27.28,56.07,56.89,63.95,74.20,78.41,96.49,108.61,112.79,120.47,141.41,156.38,157.98,163.57,163.97 化合物5： 29.92 ,127.72 ,127.72 ,127.91 ,127.91 ,128.90 ,129.14 ,129.27 ,129.27 ,129.41 ,130.42 ,130.42 ,130.79 ,132.19 ,133.71 ,134.49 ,136.31 ,139.39 ,147.57 ,165.73 化合物6： 52.62 ,115.49 ,120.58 ,123.47 ,123.77 ,124.37 ,125.07 ,127.23 ,127.27 ,127.43 ,127.98 ,128.57 ,129.04 ,131.27 ,133.09 ,135.09 ,137.81 ,139.00 ,141.19 ,145.47 ,167.20 ,169.03 |
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kaola0916
铁杆木虫 (著名写手)
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【答案】应助回帖
感谢参与，应助指数 +1
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化合物1 查询结果：共查到16个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . (-)-1-norvincorine(b) 相似度:61.9% Planta Medica 1988 54 214-218 Relative Configuration and Cytotoxic Activity of Vincarubine: A Novel Bisindole Alkaloid from Vinca minor B. Proksat, D. Uhrfn, E. Grossmann, Z. Votickt, and J. Fuska Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 11-Hydroxyrhazimanine C21H26N2O4 相似度:61.9% Chemistry of Natural Compounds 2009 45 834-836 INDOLE ALKALOIDS FROM LEAVESAND STEMS OF Hunteria zeylanica Yong-Jiang Xu, Chun-Ping Tang,Chang-Qiang Ke, and Yang Ye Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 10-methoxy-3-epi-α-yohimbine C22H28N2O4 相似度:59.0% Phytochemistry 1989 28 667-670 Alkaloids of Alstonia coriacea Abdallah Cherif,Georges Massiot,Louisette Le Men-Olivier,Jacques Pusset,Stéphane Labarre Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 10-hydroxy-19,20-dihydroisositsirikine C21H28N2O4 相似度:57.1% Chinese Chemical Letters 2006 17 783-786 Alkaloids from Stems of Ervatamia yunnanensis (II) Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . Methyl 3-[2-(3,4-dimethoxyphenyl)-7-hydroxy-3-methoxycarbonyl-2,3-dihydro-1-benzofuran-5-yl]propanoate) C22H24O8 相似度:54.5% Molecules 2000 5 153-161 Synthesis of 4-O-Methylcedrusin. Selective Protection of Catechols with Diphenyl Carbonate Stefaan M. O. Van Dyck, Guy L. F. Lemière, Tim H. M. Jonckers and Roger Dommisse Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . Compound 2n 相似度:54.5% Magnetic Resonance in Chmesitry 2003 41 549-553 1H and 13C chemical shifts for acridines: Part XVIII. 9-Chloroacridine and 9-(N-allyl)-and 9-(N-propargyl)acridinamine derivatives G. Roubaud, R. Faure and J.-P. Galy Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . (–)-Mehranine C20H26N2O 相似度:52.3% Chemistry of Natural Compounds 2008 44 675-678 INDOLE ALKALOIDS FROM Ervatamia flabellformia Shuang Liang, Haisheng Chen, Li Jin,Weidong Xuan, and Wei-Dong Zhang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . De-O-methylracemosol C26H28O7 相似度:52.3% Phytochemistry 1994 36 817-818 De-O-methylracemosol: A tetracyclic 2, 2-dimethylchroman from the roots of Bauhinia racemosa Palanisamy Prabhakar, Rathinasamy Gandhidasan, Pathai Venkateswara Raman, N.R. Krishnasamy, Srinivas Nanduri Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 15-β-Stemmadenine 相似度:52.3% Magnetic Resonance in Chmesitry 2002 40 474-476 A new stereoisomer of stemmadenine alkaloid from Tabernaemontana heyneana Rajesh K. Grover, Sudhir Srivastva, D. K. Kulshreshtha and Raja Roy Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . compound 6 C29H38BrN3S 相似度:52.3% Pharmazie 2000 55 803-810 Synthesis, antimicrobial testing and QSAR study of new 2-phenylethenylbenzothiazolium salts substituted by cyclic amines P. Magdolen - P. Zahradník - P. Foltínová Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . gaultherin D C21H24O6 相似度:52.3% Heterocycles 2000 53 675-679 Gaulthrins C and D, Two New Lignans from the Roots of Gaultheria yunnanensis Zhizhen Zhang, Dean Guo,* Junhua Zheng, Kazuo Koike, Zhonghua Jia, and Tamotsu Nikaido Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 5-chloro-3-[2-(5-chloro-2,3-dihydro-indol-1-yl)-ethyl]-1H-indole C18H16N2F2 相似度:52.3% Bioorganic & Medicinal Chemistry 2009 17 6073-6084 Fascaplysin-inspired diindolyls as selective inhibitors of CDK4/cyclin D1 Carine Aubry, A. James Wilson, Daniel Emmerson, Emma Murphy, Yu Yam Chan, Michael P. Dickens, Marcos D. García, Paul R. Jenkins, Sachin Mahale, Bhabatosh Chaudhuri Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 9-Methoxy-3-epi-α-yohimbine C22H28N2O4 相似度:50% Chemical & Pharmaceutical Bulletin 2004 52(3) 359-361 A New 9-Methoxyyohimbine-Type Indole Alkaloid from Mitragyna africanus Hiromitsu TAKAYAMA,Hayato ISHIKAWA,Mariko KITAJIMA,Norio AIMI,and Baba Muhammad AJI Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . β-colubrine 相似度:50% Acta Pharmaceutica Sinica 1994 29 44-48 ANALYSIS OF SPECTRAL DATA FOR 13CNMR OF SIXTEEN STRYCHNOS ALKALOIDS BC Cai; H Wu; XW Yang; M Hattori and T Nainba Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . isostegane 相似度:50% Journal of Natural Products 1992 Vol 55 184 The Role of Dianion Coupling in the Synthesis of Dibenzylbutane Lignans John L. Belletire, Douglas F. Fry, Susan L. Fremont Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . β-colubrine 相似度:50% Organic Magnetic Resonance 1984 22 345-348 Carbon-13 NMR spectroscopy of some Strychnos alkaloids. Part 2 R. Verpoorte, T. A. van Beek, R. L. M. Riegman, P. J. Hylands and N. G. Bisset Structure 13C NMR 碳谱模拟图 |
2楼2012-05-07 09:46:49
kaola0916
铁杆木虫 (著名写手)
- 应助: 173 (高中生)
- 金币: 7183.8
- 散金: 35
- 红花: 11
- 帖子: 1591
- 在线: 471.7小时
- 虫号: 856177
- 注册: 2009-09-25
- 专业: 药剂学
【答案】应助回帖
|
化合物2 查询结果：共查到3203个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 2α,23-dihydroxyursolicacid C30H48O5 相似度:90% Acta Botanica Yunnanica 2010 32 455-462 A New Lignan from Elaeagnus lanceolata (Elaeagnaceae) SONG We i-Wu, LIBo, LIU Ji-Kai Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . asiatic acid C30H48O5 相似度:80% China Journal of Chinese Materia Medica 2006 31 1875-1879 Triterpenes from herb of Potentilla chinesis LIU Pu, DUAN Hongquan, PAN Qin, ZHANG Yanwen, YAO Zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 2α,3β,23-Trihydroxyurs-12-en-28-amide 相似度:78.5% Chemistry & Biodiversity 2009 6 864-874 Synthesis and Biological Evaluation of Asiatic Acid Derivatives as Inhibitors of Glycogen Phosphorylases Liying Zhang, Jun Chen, Yanchun Gong, Jun Liu, Luyong Zhang, Weiyi Hua, and Hongbin Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 2-epi-corosolic acid C30H48O4 相似度:75.8% Bioorganic & Medicinal Chemistry Letters 2007 17 5777-5782 Pentacyclic triterpenes. Part 5: Synthesis and SAR study of corosolic acid derivatives as inhibitors of glycogen phosphorylases Xiaoan Wen, Jun Xia, Keguang Cheng, Liying Zhang, Pu Zhang, Jun Liu, Luyong Zhang, Peizhou Ni, Hongbin Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . Asiatic acid 相似度:74.0% Archives of Pharmacal Research 2005 28 1135-1141 Inhibitory effect on TNF-α-induced IL-8 production in the HT29 cell of constituents from the leaf and stem ofWeigela subsessilis Phuong Thien Thuong, WenYi Jin, JongPill Lee, RackSeon Seong and Young-Mi Lee, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . corosolic acid C30H48O4 相似度:73.3% China Journal of Chinese Materia Medica 2006 31 1875-1879 Triterpenes from herb of Potentilla chinesis LIU Pu, DUAN Hongquan, PAN Qin, ZHANG Yanwen, YAO Zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 2α,3α-dihydroxyurs-12-en-28-oic acid C30H48O4 相似度:73.3% China Journal of Chinese Materia Medica 2006 31 1875-1879 Triterpenes from herb of Potentilla chinesis LIU Pu, DUAN Hongquan, PAN Qin, ZHANG Yanwen, YAO Zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 3β,7β,24-Trihydroxy-urs-12-en-28-oic acid C30H48O5 相似度:73.3% Phytochemistry Letters 2011 4 287-291 Ursolic acid derivatives from Bangladeshi medicinal plant, Saurauja roxburghii:Isolation and cytotoxic activity against A431 and C6 glioma cell lines Kishor Mazumder, Eric R.O. Siwu, Satoshi Nozaki, Yasuyoshi Watanabe, Katsunori Tanaka, Koichi Fukase Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . asiatic acid 相似度:73.3% Journal of the Chemical Society Perkin Transactions 2 1987 1509-1515 Stereochemistry of a Triterpenoid Trisaccharide from Centella asiatica. X-Ray Determination of the Structure of Asiaticoside Shashi 0. Mahato and Niranjan P. Sahu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 2α,3α,24-二烯三羟基乌苏-12-烯-28-酸 相似度:73.3% Chinese Traditional and Herbal Drugs 2006 37 1780-1781 连钱草中三萜类化学成分 张前军;杨小生;朱海燕;姚云;郝小江;宋宝安 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 2α,3α,23-trihydroxylurs-12-en-28-oic acid 相似度:73.3% Chinese Journal of Natural Medicines 2009 7 421-424 Triterpenes from Prunella vulgaris QI Jin; HU Zheng-Fang; LIU Zhi-Jun; YU Bo-Yang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . Myrianthic acid 相似度:73.3% Archives of Pharmacal Research 2004 27 376-380 Anti-platelet pentacyclic triterpenoids from leaves of campsis grandiflora Jing Ling Jin, Yong Yook Lee, Jung Eun Heo, Sanghyun Lee and Jeong Mi Kim, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 2α,3α,23-trihydroxyurs-12-en-28-oic acid C30H48O5 相似度:73.3% Journal of Shenyang Pharmaceutical University 2010 27 715-718 Simultaneous determ ination of the content of three sulfides in Allium tuberosum by GC XU Chao, TAN Liang, CHEN Xiao-hui, BI Kai-shun, JIA Ying Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 2α,3α,24-trihydroxyurs-12-en-28-oic acid 相似度:73.3% Journal of Shenyang Pharmaceutical University 2010 27 715-718 Simultaneous determ ination of the content of three sulfides in Allium tuberosum by GC XU Chao, TAN Liang, CHEN Xiao-hui, BI Kai-shun, JIA Ying Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . β-sitosterol 相似度:73.3% Journal of China Pharmaceutical University 2000 31 91-93 Studies on Constituents of Centella asiatica (L.)Urb HE Ming Fang; MENG Zheng Mu; WO Lian Qun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . 2α,3α-dihydroxyurs-12-en-28-oic acid 相似度:73.3% Natural Product Research and Development 2007 19 978-981 Chemical Study on Saurauia napaulensis XIAO Yan-hua;ZHANG Ai-lian; ZHANG Guo-lin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . 3β,6β,19α-trihydroxyurs-12-en-28 oic acid 相似度:72.4% Acta Pharmaceutica Sinica 2001 Vol 36 120-122 STUDIES ON THE CHEMICAL CONSTITUENTS OF UNCARIA YUNANENSIS HSIA.C.C TAO Zhao yang; YI Yang hua; XU Qian zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . Carboxymethyl 2α,3β,23-Trihydroxyurs-12-en-28-oate 相似度:71.8% Chemistry & Biodiversity 2009 6 864-874 Synthesis and Biological Evaluation of Asiatic Acid Derivatives as Inhibitors of Glycogen Phosphorylases Liying Zhang, Jun Chen, Yanchun Gong, Jun Liu, Luyong Zhang, Weiyi Hua, and Hongbin Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . Ursolic acid 相似度:70% Chemical & Pharmaceutical Bulletin 2008 56(9) 1253-1258 Microbial Metabolism of Biologically Active Secondary Metabolites from Nerium oleander L. Amany IBRAHIM,Sherief Ibrahim KHALIFA,Ishrak KHAFAGI,Diaa Tohamy YOUSSEF,Shabana KHAN,Mostafa MESBAH,and Ikhlas KHAN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 2α,3α,23,29-tetrahydroxyolean-12-en-28-oic acid C30H48O6 相似度:70% Journal of Natural Products 2002 65 1777-1781 Chemical Constituents of the Aerial Parts of Schnabelia tetradonta Hui Dou, Yan Zhou, Changxiang Chen, Shulin Peng, Xun Liao, and Lisheng Ding Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . Eriantic Acid B 相似度:70% Chemistry & Biodiversity 2009 6 864-874 Synthesis and Biological Evaluation of Asiatic Acid Derivatives as Inhibitors of Glycogen Phosphorylases Liying Zhang, Jun Chen, Yanchun Gong, Jun Liu, Luyong Zhang, Weiyi Hua, and Hongbin Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . 2α,3α,19α,23-Tetrahydroxyurs-12-en-28-oic Acid 相似度:70% Journal of Asian Natural Products Research 2003 5 49-56 BIOACTIVE TRITERPENOIDS FROM SYMPLOCOS CHINENSIS XI-HAO LI, DIAN-DIAN SHEN, NAN LI and SHI-SHAN YU Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . 3β-6β-23-trihydroxyurs-12-en-28-oic acid 相似度:70% China Journal of Chinese Materia Medica 2007 32 1182-1184 Studies on chemical constituents in herb of Centella asiatica YU Quanlin, GAO Wenyun, ZHANG Yanwen, TENG Jie, DUAN Hongquan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . euscaphic acid 相似度:70% China Journal of Chinese Materia Medica 2007 32 496-500 Studies on chemical constituents in fruits of Eucalyptus globulus YANG Xiuwei, GUO Qingmei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . ursolic acid C30H48O3 相似度:70% China Journal of Chinese Materia Medica 2006 31 1875-1879 Triterpenes from herb of Potentilla chinesis LIU Pu, DUAN Hongquan, PAN Qin, ZHANG Yanwen, YAO Zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . myrianthic acid C30H48O6 相似度:70% China Journal of Chinese Materia Medica 2006 31 1875-1879 Triterpenes from herb of Potentilla chinesis LIU Pu, DUAN Hongquan, PAN Qin, ZHANG Yanwen, YAO Zhi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . 2α,3α,23-trihydroxy-urs-12-en-28-oic acid C30H48O5 相似度:70% China Journal of Chinese Materia Medica 2005 30 1926-1932 Studies on triterpenoid constituents from Rabdosia japonica var. galaucocalyx Wang Fudong, DING Lan, WANG Hanqing Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . 2α,3α,23-trihydroxyurs-12-en-28-oic acid 相似度:70% Phytochemistry 1992 31 2801-2804 Triterpenoids from the fruit galls of Actinidia polygama Yutaka Sashida, Kazunori Ogawa, Noriaki Mori, Tsuyoshi Yamanouchi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 乌索酸 相似度:70% Chinese Traditional and Herbal Drugs 2011 42(4) 661-663 Chemical constituents of Paederia scandens YU Xiao-yan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . 2α,3β,23-trihydroxyurs-12-en-28-oic acid 相似度:70% Archives of Pharmacal Research 2011 Vol 34,No 7 1097-1105 Constituents of the Root of Anemone tomentosa Hao-Bin Hu, Xu-Dong Zheng, Yu-Feng Jian, Jian-Xin Liu, and Ji-Hua Zhu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 3β-hydroxyurs-12-en-28-oic acid 相似度:70% Magnetic Resonance in Chmesitry 2000 38 201-206 Complete assignment of the 1H and 13C NMR spectra of four triterpenes of the ursane, artane, lupane and friedelane groups Josinete S. Alves, Janiza C. M. de Castro, Maisa O. Freire, Emidio V. Leitão da-Cunha, José Maria Barbosa-Filho and Marcelo Sobral de Silva Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . compound 11 相似度:70% Phytochemistry 1984 23 2829-2834 β-glucosyl esters of 19α-hydroxyursolic acid derivatives in leaves of Rubus species Takashi Seto, Takashi Tanaka, Osamu Tanaka, Naohiro Naruhashi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . 2α,3β,23-trihydroxy urs-12-en-28-oic acid 相似度:70% Chinese Traditional and Herbal Drugs 2010 41 11-14 Studies on constituents from pericarps of Juglans mandshurica with anti-tumor activity ZHOU Yuan-yuan; WANG Dong; NIU Feng Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . 2α,3α,23-三羟基-12-烯-28-乌苏酸 C30H48O5 相似度:70% Chinese Traditional and Herbal Drugs 2009 40 1549-1551 清明花枝叶化学成分的研究 王培;宋启示;徐蔚;李尚真 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . 2α-羟基乌苏酸 C30H48O4 相似度:70% Chinese Traditional and Herbal Drugs 2008 39 978-981 日本路边青的化学成分研究 赵晶;高文远;段宏泉;滕杰;高石喜久 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . corosolic acid C30H48O4 相似度:70% Chinese Traditional and Herbal Drugs 2007 38 1311-1313 蛇莓中具有抗癌活性的三萜类成分 吴培楠;段宏泉;姚智;潘勤;张富赓 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . 2α,3α,19α,23-tetrahydroxyurs-12-en-28-oic acid C30H48O6 相似度:70% Chinese Journal of Natural Medicines 2006 4 271-274 Isolation and Identification of Terpenes from Coleus forskohlii SHAN Yu-Pei; KONG Ling-Yi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . ursolic acid 相似度:70% Chinese Pharmaceutical Journal 2005 40 1059-1061 Studies on chemical constituents from Gentianopsis paludosa WANG Huan-di, TAN Cheng-yu, DU Yu-guang, BAI Xue-fang, LEV Bing-cheng Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . ursolic acid C30H48O3 相似度:70% Chinese Journal of Medicinal Chemistry 2011 21 220-225 Chemical constituents from dried fruits of Rubus chingii XIAO Hong-ming, ZU Ling-bo, LI Shi-ping, WANG Kai-jin, LI Ning* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . 2α,3α,23-trihydroxyurs-12,20(30)-dien-28-oic acid C30H48O5 相似度:70% Journal of Shenyang Pharmaceutical University 2010 27 715-718 Simultaneous determ ination of the content of three sulfides in Allium tuberosum by GC XU Chao, TAN Liang, CHEN Xiao-hui, BI Kai-shun, JIA Ying Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . 3β,27-dihydroxyluo-12-ene 相似度:70% Natural Product Research and Development 2009 21 970-972 Chemical Constituents of Plagiogyria maxima and Plagiogyria distinctissima TAI Zhi-gang; YANG Xue-qiong; CAI Le; HUANG Rong; YANG Ming-hui; DING Zhong-tao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . ursolic acid 相似度:70% Natural Product Research and Development 2000 12(6) 13-16 STUDY ON THE CHEMICAL CONSTITUENTS OF ORIGANUM VULGARE L. Wu Rui; Ye Qi; Chen Nengyu; Zhang Guolin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . myrianthic acid 相似度:70% Journal of the Chinese Chemical Society 2005 52 1275-1280 Triterpene Acids from the Leaves of Planchonella duclitan (Blanco) Bakhuizan Tzong-Huei Lee*, Shin-Hun Juang Feng-Lin Hsu and Cheng-Yi Wu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . corosolic acid 相似度:70% Journal of the Chinese Chemical Society 2005 52 1275-1280 Triterpene Acids from the Leaves of Planchonella duclitan (Blanco) Bakhuizan Tzong-Huei Lee*, Shin-Hun Juang Feng-Lin Hsu and Cheng-Yi Wu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . ursolic acid 相似度:70% Journal of the Chinese Chemical Society 2005 52 1275-1280 Triterpene Acids from the Leaves of Planchonella duclitan (Blanco) Bakhuizan Tzong-Huei Lee*, Shin-Hun Juang Feng-Lin Hsu and Cheng-Yi Wu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . ursolic acid 相似度:70% Korean Journal of Pharmacognosy 2010 41 97-102 Inhibition of IL-6 Production in TNF-α Stimulated MG-63 by the Triterpenoids Isolated from Aucuba japonica Qinglong Jin, Hong-Guang Jin, Ji Eun Shin, Eun Jin Choi and Eun-Rhan Woo Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . 2α,3α,23-trihydroxy-urs-12-en-28-oic acid C30H48O5 相似度:68.9% Natural Product Sciences 1997 3 75-78 Tectona grandis Callus Produces Antibacterial Triterpene Acids Not Detected in the Intact Plant Marwani, Erly; Kobayashi, Akio; Kajiyama, Shin-ichiro; Fukusaki, Eiichiro; Nitoda, Teruhiko; Kanzaki, Hiroshi; Kawazu, Kazuyoshi Structure 13C NMR 碳谱模拟图 |
3楼2012-05-07 09:52:19
kaola0916
铁杆木虫 (著名写手)
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化合物3 查询结果：共查到123个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 19S-Heyneanine 相似度:63.6% Phytochemistry 1980 19 1213-1218 Anticancer indole alkaloids of Ervatamia heyneana Sarath P. Gunasekera, Geoffrey Cordell, Norman R. Farnsworth Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . yohimbinic acid C20H26N2O3 相似度:59.0% Journal of Natural Products 2005 68 848-852 Indole Alkaloids and Other Constituents of Rauwolfia serpentina Atsuko Itoh, Tomoko Kumashiro, Machiko Yamaguchi, Naotaka Nagakura, Yoshiyuki Mizushina, Toyoyuki Nishi, and Takao Tanahashi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . voacristine 相似度:59.0% Planta Medica 1983 49 148-150 Tertiary Indole Alkaloids from Leaves of Tabernaemontana dichotoma Premila Perera, Gunnar Samuelsson, Tens A. van Beek and Robert Verpoorte Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 19R-epi-heyneanine 相似度:59.0% Planta Medica 1983 49 148-150 Tertiary Indole Alkaloids from Leaves of Tabernaemontana dichotoma Premila Perera, Gunnar Samuelsson, Tens A. van Beek and Robert Verpoorte Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . (-)-3R-Methoxycoronaridine 相似度:59.0% Phytochemistry 1994 37 1729-1735 Indole alkaloids and terpenoids fromTabernaemontana markgrafiana Helene B. Nielsen, Alan Hazell, Rita Hazell, Felipe Ghia, Kurt B.G. Torssell Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . heyneanine 相似度:59.0% Helvetica Chimica Acta 1976 59 2437-2442 13C-NMR. Spectroscopy of Naturally Occurring Substances. XLV. Iboga Alkaloids Ernest Wenkert, David W. Cochran, Hugo E. Gottlieb, Edward W. Hagaman, Raimundo Braz Filho, Francisco José de Abreu Matos and Maria Iracema Lacerda Machado Madruga Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 19-isoheyneanine 相似度:59.0% Helvetica Chimica Acta 1976 59 2437-2442 13C-NMR. Spectroscopy of Naturally Occurring Substances. XLV. Iboga Alkaloids Ernest Wenkert, David W. Cochran, Hugo E. Gottlieb, Edward W. Hagaman, Raimundo Braz Filho, Francisco José de Abreu Matos and Maria Iracema Lacerda Machado Madruga Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . ajmalicidine 相似度:59.0% Planta Medica 1994 60 480-481 On the Structure of the Indole Alkaloid Ajmalicidine Lounasmaa, M.; Tolvanen, A. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . ajmalicidine C21H26N2O4 相似度:59.0% Phytochemistry 1987 26 875-877 Ajmalicidine an alkaloid from Rauwolfia serpentina Salimuzzaman Siddiqui,S.Salman Ahmad,S.Imtiaz Haider,Bina Shaheen Siddiqui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . Voacangarine 相似度:59.0% Phytochemistry 1980 19 1213-1218 Anticancer indole alkaloids of Ervatamia heyneana Sarath P. Gunasekera, Geoffrey Cordell, Norman R. Farnsworth Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . β-yohimbine C21H26N2O3 相似度:59.0% Chinese Pharmaceutical Journal 2000 35 11-13 Studies on the chemical constituents of Lycorma delicatula Xue Gongda (Xue GD), Yuan Sitong (Yuan ST), Wang Zhimin (Wang ZM) Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 2-methyl acrylyl-6-methoxytryptophan ethyl ester 相似度:58.3% Bioorganic & Medicinal Chemistry 2008 16 4626-4651 Synthesis and structure–activity relationship studies on tryprostatin A, an inhibitor of breast cancer resistance protein Hiteshkumar D. Jain, Chunchun Zhang, Shuo Zhou, Hao Zhou, Jun Ma, Xiaoxiang Liu, Xuebin Liao, Amy M. Deveau, Christine M. Dieckhaus, Michael A. Johnson, Kirsten S. Smith, Timothy L. Macdonald, Hideaki Kakeya, Hiroyuki Osada, James M. Cook Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 3R-ethoxyheyneanine C22H28N2O4 相似度:56.5% Journal of Natural Products 2002 65 669-672 Five New Iboga Alkaloids from Tabernaemontana corymbosa Toh-Seok Kam and Kooi-Mow Sim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . compound 16 C25H38O5 相似度:56% Tetrahedron Letters 2003 44 4233-4237 Guanacastepene-A total synthesis: construction of the tricyclic iso-guanacastepane, epi-guanacastepane and guanacastepane frameworks Goverdhan Mehta, Jayant D. Umarye, Kalidindi Srinivas Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 19-epi-isovoacristine C22H28N2O4 相似度:54.5% Journal of Natural Products 2002 65 669-672 Five New Iboga Alkaloids from Tabernaemontana corymbosa Toh-Seok Kam and Kooi-Mow Sim Structure 13C NMR 碳谱模拟图 |
4楼2012-05-07 09:56:04
kaola0916
铁杆木虫 (著名写手)
- 应助: 173 (高中生)
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化合物4 查询结果：共查到12个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . meranzin hydrate 相似度:58.8% Phytochemistry 2000 53 689-697 Coumarins and bicoumarin from Ferula sumbul: anti-HIV activity and inhibition of cytokine release Ping Zhou, Yoshihisa Takaishi, Hongquan Duan, Bei Chen, Gisho Honda, Michiho Itoh, Yoshio Takeda, Olimjon K. Kodzhimatov, Kuo-Hsing Lee Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . Perforatin D C17H22O6 相似度:58.8% Phytochemistry 1995 40 1787-1790 Chromones from Harrisonia perforata Tomoko Tanaka, Kazuo Koike, Katsuyoshi Mitsunaga, Keiko Narita, Seiko Takano, Akiko Kamioka, Emi Sase, Yishan Ouyang, Taichi Ohmoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . leptin E C17H24O6 相似度:52.9% Phytochemistry 1998 47 101-104 Chromans from Evodia lepta Guo-Lin Li, Jia-Feng Zeng, Da-Yuan Zhu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . Perforatin E C17H22O7 相似度:52.9% Phytochemistry 1995 40 1787-1790 Chromones from Harrisonia perforata Tomoko Tanaka, Kazuo Koike, Katsuyoshi Mitsunaga, Keiko Narita, Seiko Takano, Akiko Kamioka, Emi Sase, Yishan Ouyang, Taichi Ohmoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . (rel)-6-acetyl-3,4-dihydro-4α-ethoxy-3β-hydroxy-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran C17H24O6 相似度:52.9% Phytochemistry 1994 37 565-570 Acetophenones and coumarins from stem bark and leaves of Melicope stipitata Ian C. Parsons, Alexander I. Gray, Thomas G. Hartley, Peter G. Waterman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . coriandrone B C16H20O5 相似度:52.9% Phytochemistry 1991 30 4143-4146 Isocoumarins from Coriandrum sativum Kimiye Baba, Yong-Qing Xiao, Masahiko Taniguchi, Hirofumi Ohishi, Mitsugi Kozawa Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . meranzin hydrate 相似度:52.9% Phytochemistry 1987 26 2547-2549 Coumarin glycosides from Citrus flavedo David McHale,Paraj P. Khopkar,John B. Sheridan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 6-[1'-Oxo-3'(R)-methoxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran C18H24O5 相似度:52.9% Archives of Pharmacal Research 2005 28 1131-1134 New cytotoxic benzopyrans from the leaves of Mallotus apelta Phan Van Kiem, Nguyen Hai Dang, Ha Viet Bao, Hoang Thanh Huong and Chau Van Minh, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . (2R,3S)-3-(2'-furyl)-1,2-isopropylidenedioxy-3-pentanol C12H18O4 相似度:52.9% Heterocycles 2001 54 341-350 Diastereoselective Addition of Organometallic Reagents to (R)-2,3-Isopropylidenedioxy-1-(2-furyl)-1-propanone Yielding Chiral Tertiary Furyl Carbinols Masayoshi Tsubuki,* Naohiro Tarumoto, and Toshio Honda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 3,4,7,9-tetramethoxy-1-methyl-6H-dibenzo[b,d]pyran-6-one C18H18O6 相似度:50% Heterocycles 2010 82 851-855 Synthesis of Graphislactone H Hitoshi Abe, Tomoko Fukumoto, Yoshikazu Horino, Takashi Harayama, and Yasuo Takeuchi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . Compound 11 C21H24N4O4 相似度:50% Bioorganic & Medicinal Chemistry Letters 2003 13 175-178 New arylpiperazine derivatives with high affinity for α1A, D2 and 5-HT2A receptors J. C. González-Gómez, L. Santana, E. Uriarte, J. Brea, M. Villazón, M. I. Loza, M. De Luca, M. E. Rivas, G. Y. Montenegro, J. A. Fontenla Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . pentacyclic ketal 相似度:50% Tetrahedron Letters 2001 42 231-234 An expeditious construction of polycyclic ketals: synthesis of fused seven-membered rings and substituted naphthalenes Issam Hanna, Valérie Michaut, Louis Ricard Structure 13C NMR 碳谱模拟图 |
5楼2012-05-07 10:07:30
kaola0916
铁杆木虫 (著名写手)
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紫苏一幽香: 金币+60, ★★★很有帮助, 多谢！ 2012-05-07 11:29:08
紫苏一幽香: 金币+60, ★★★很有帮助, 多谢！ 2012-05-07 11:29:08
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化合物5 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 29.92,127.72,127.72,127.91,127.91,128.90,129.14,129.27,129.27,129.41,130.42,130.42,130.79,132.19,133.71,134.49,136.31,139.39,147.57,165.73 溶剂选项： 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值 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3266个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . Benzyl 4-(quinolin-3-yl)benzoate 相似度:80.9% Archiv der Pharmazie 2008 341 478-484 Structural Modifications of Salicylates: Inhibitors of Human CD81-Receptor HCV-E2 Interaction Marcel Holzer, Sigrid Ziegler, Alexander Neugebauer, Bernd Kronenberger, Christian D. Klein and Rolf W. Hartmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . Compond 4a 相似度:80% Magnetic Resonance in Chmesitry 2003 41 193-201 1H, 13C, 17O NMR and quantum-chemical study of the stereochemistry of the sulfoxide and sulfone derivatives of 3-arylidene-1-thioflavan-4-one epoxides József Kovács, Gábor Tóth, András Simon, Albert Lévai, Andreas Koch and Erich Kleinpeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 4-(Quinolin-3-yl)benzyl 4-(quinolin-3-yl)benzoate 相似度:76.1% Archiv der Pharmazie 2008 341 478-484 Structural Modifications of Salicylates: Inhibitors of Human CD81-Receptor HCV-E2 Interaction Marcel Holzer, Sigrid Ziegler, Alexander Neugebauer, Bernd Kronenberger, Christian D. Klein and Rolf W. Hartmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . N-(2-Chlorophenyl)-2-naphthamide C17H12NOCl 相似度:75% Molecules 2012 17 613-644 Investigating the Spectrum of Biological Activity of Substituted Quinoline-2-Carboxamides and Their Isosteres Tomas Gonec, Pavel Bobal, Josef Sujan, Matus Pesko, Jiahui Guo, Katarina Kralova,Lenka Pavlacka, Libor Vesely, Eva Kreckova, Jiri Kos, Aidan Coffey, Peter Kollar,Ales Imramovsky, Lukas Placek and Josef Jampilek Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 1-benzyl-2,4,5-triphenylimidazole C28H22N2 相似度:75% Heterocycles 2004 63 87-93 One-Pot Synthesis of Tetra-substituted Imidazoles on Silica Gel under Microwave Irradiation Yu Xu, Yan-Zhi Liu, Lei Rui, Lei Liu, and Qing-Xiang Guo* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . acridin-4-ylmethyl benzoate C21H15NO2 相似度:75% Heterocycles 2003 60 1653-1672 Synthesis and Crystallographic Studies of New Acridinic Esters and Amides: An Efficient Synthetic Route to 4-Methyl Functionalized Acridines Julien Chiron* and Jean-Pierre Galy Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . Compound 2f 相似度:75% Magnetic Resonance in Chmesitry 2001 39 251-258 NMR and quantum-chemical study of the stereochemistry of spiroepoxides obtained by oxidation of (Z)-3-arylidene-1-thioflavan-4-ones Gábor Tóth, József Kovács, Albert Lévai, Erich Kleinpeter and Andreas Koch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . Compound 3a 相似度:75% Magnetic Resonance in Chmesitry 2001 39 251-258 NMR and quantum-chemical study of the stereochemistry of spiroepoxides obtained by oxidation of (Z)-3-arylidene-1-thioflavan-4-ones Gábor Tóth, József Kovács, Albert Lévai, Erich Kleinpeter and Andreas Koch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . Compound 3f 相似度:75% Magnetic Resonance in Chmesitry 2001 39 251-258 NMR and quantum-chemical study of the stereochemistry of spiroepoxides obtained by oxidation of (Z)-3-arylidene-1-thioflavan-4-ones Gábor Tóth, József Kovács, Albert Lévai, Erich Kleinpeter and Andreas Koch Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 2,4-Disubstituted-2,3-dihydro-1 H-naphtho[1,4]diazepine C33H23ClN2S 相似度:75% Archives of Pharmacal Research 2004 27 1194-1201 Synthesis and pharmacological screening for muscle relaxant, anticonvulsant, and sedative activities of certain Organic compounds produced by Michael addition Makarem M. Said, Amany A. E. Ahmed and Abir T. El-Alfy Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 1,3,4-triphenyl-5-parachlorobenzoylpyrazole 相似度:75% Tetrahedron Letters 2004 45 4143-4148 Ultrasound-accelerated aromatisation of trans- and cis-pyrazolines under heterogeneous conditions using claycop Siham Mallouk, Khalid Bougrin, Hayat Doua, Rachid Benhida, Mohamed Soufiaoui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 2-{[2-(2-Naphthylsulfonyl)hydrazono}methyl]phenyl 3-nitrobenzenesulfonate C23H17N3O7S2 相似度:73.9% Molecules 2008 13 11-30 Design and Synthesis of Novel N-Benzylidenesulfonohydrazide Inhibitors of MurC and MurD as Potential Antibacterial Agents Rok Frlan, Andreja Kovač, Didier Blanot, Stanislav Gobec, Slavko Pečar and Aleš Obreza Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 3-benzoyl-4-(4-chlorophenyl)-2-phenyl-5-(phenylsulfanylmethyl)furan C30H21O2ClS 相似度:72.7% Chemical & Pharmaceutical Bulletin 2010 58 1180-1186 Scandium-Catalyzed Propargylation of 1,3-Diketones with Propargyl Alcohols Bearing Sulfur or Selenium Functional Groups: Useful Transformation to Furans and Pyrans Katsuki Ohta, Taira Kobayashi, Genzoh Tanabe, Osamu Muraoka and Mitsuhiro Yoshimatsu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 2-{[2-(2-Naphthylsulfonyl)hydrazono}methyl]phenyl 4-nitrobenzenesulfonate C23H17N3O7S2 相似度:71.4% Molecules 2008 13 11-30 Design and Synthesis of Novel N-Benzylidenesulfonohydrazide Inhibitors of MurC and MurD as Potential Antibacterial Agents Rok Frlan, Andreja Kovač, Didier Blanot, Stanislav Gobec, Slavko Pečar and Aleš Obreza Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 2,3,4,7-tetraphenyl-2H-pyrazolo[3,4-d]pyridazine C29H20N4 相似度:71.4% Journal of Heterocyclic Chemistry 2010 47 1040-1048 Synthesis and characterization of some pyrazole derivatives of 1,5-diphenyl-1H-pyrazole-3,4-dicarboxylic acid Rahmi Kasımoğulları and B. Seçkin Arslan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . 2-(4-Chlorophenyl)-3,4-diphenylquinoline C27H18NCl 相似度:71.4% Molecules 2010 15 7423-7437 One-Pot Synthesis of 2,3,4-Triarylquinolines via Suzuki-Miyaura Cross-Coupling of 2-Aryl-4-chloro-3-iodoquinolines with Arylboronic Acids Malose Jack Mphahlele and Mamasegare Mabel Mphahlele Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . Compond 4b 相似度:71.4% Magnetic Resonance in Chmesitry 2003 41 193-201 1H, 13C, 17O NMR and quantum-chemical study of the stereochemistry of the sulfoxide and sulfone derivatives of 3-arylidene-1-thioflavan-4-one epoxides József Kovács, Gábor Tóth, András Simon, Albert Lévai, Andreas Koch and Erich Kleinpeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . 1,3,4-triphenyl-5-paramethoxybenzoyl pyrazole 相似度:71.4% Tetrahedron Letters 2004 45 4143-4148 Ultrasound-accelerated aromatisation of trans- and cis-pyrazolines under heterogeneous conditions using claycop Siham Mallouk, Khalid Bougrin, Hayat Doua, Rachid Benhida, Mohamed Soufiaoui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . N-(4-{[2-(2-Naphthylsulfonyl)hydrazono]methyl}phenyl)-4-nitrobenzamide C24H18N4O5S 相似度:70% Molecules 2008 13 11-30 Design and Synthesis of Novel N-Benzylidenesulfonohydrazide Inhibitors of MurC and MurD as Potential Antibacterial Agents Rok Frlan, Andreja Kovač, Didier Blanot, Stanislav Gobec, Slavko Pečar and Aleš Obreza Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 2-(2,4-dichlorophenyl)-4,5-diphenylimidazole 相似度:70% Canadian Journal of Chemistry 2008 86 264-269 Synthesis of 2,4,5-trisubstituted imidazoles catalyzed by [Hmim]HSO4 as a powerful Brönsted acidic ionic liquid Ahmad R. Khosropour Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . cinnamyl 1-naphthoate C20H16O2 相似度:70% Canadian Journal of Chemistry 2005 83 569-573 Pd(0)-PhCOOH catalyzed addition of oxygen pronucleophiles to allenes and internal alkynes1 Nitin T. Patil, Nirmal K. Pahadi, and Yoshinori Yamamoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . 2-((4-Methylphenoxy)methyl)-N-(2,4,5-trichlorophenylcarbamothioyl)benzamide C22H17Cl3N2O2S 相似度:70% Molecules 2011 16 7593-7607 Synthesis, Spectroscopic Properties and Antipathogenic Activity of New Thiourea Derivatives Carmen Limban, Luminita Marutescu and Mariana Carmen Chifiriuc Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . compound 2b 相似度:70% Magnetic Resonance in Chemistry 2011 49 682-687 Effects of protonation and co-anion on the 1H and 13C chemical shifts of 2r, 6cdiphenylpiperidin-4-ones: evidence for the formation of ion pair V. Vimalraj and K. Pandiarajan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . 1-(p-Bromobiphenyl-4-yl)-2-phenylethanone C20H15BrO 相似度:70% Molecules 2012 17 240-247 Practical Synthesis of Hydroxychromenes and Evaluation of Their Biological Activity Jae-Chul Jung and Seikwan Oh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . N-(2-Bromophenyl)-2-naphthamide C17H12NOBr 相似度:70% Molecules 2012 17 613-644 Investigating the Spectrum of Biological Activity of Substituted Quinoline-2-Carboxamides and Their Isosteres Tomas Gonec, Pavel Bobal, Josef Sujan, Matus Pesko, Jiahui Guo, Katarina Kralova,Lenka Pavlacka, Libor Vesely, Eva Kreckova, Jiri Kos, Aidan Coffey, Peter Kollar,Ales Imramovsky, Lukas Placek and Josef Jampilek Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . 2-(3-Chlorophenyl)-3-(4-methylphenyl)-1H-inden-1-one C22H16ClO 相似度:70% 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 -------------------------------------------------------------------------------- 27 . 2,3-diphenyl-1-(phenylsulfonyl)indole C26H19NO2S 相似度:70% Tetrahedron Letters 2000 41 8717-8721 Bis-Suzuki reactions of 2,3-dihaloindoles. A convenient synthesis of 2,3-diarylindoles Yanbing Liu, Gordon W. Gribble Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . (Z)-methyl 2-benzamido-3-(benzylamino)acrylate C18H18N2O3 相似度:70% Journal of Heterocyclic Chemistry 2009 46 1235-1238 Novel and convenient to substituted imidazoles Yu-An Chang and Hsiang Chang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . (Z)-benzyl 2-benzamido-3-(benzylamino)acrylate C24H22N2O3 相似度:70% Journal of Heterocyclic Chemistry 2009 46 1235-1238 Novel and convenient to substituted imidazoles Yu-An Chang and Hsiang Chang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . 5-[1-(2-furyl)-2-methyl-2-nitropropyl]-4-(2-naphthyl)-1,2,3-selenadiazole C20H17N3O3Se 相似度:70% Journal of Heterocyclic Chemistry 2006 43 149-155 Synthesis and characterization of 4-aryl-5-(1-aryl-2-methyl-2-nitropropyl)-1,2,3-selenadiazoles Sivaperuman Saravanan,Arumugam Nithya and Shanmugam Muthusubramanian Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 3-(4-bromophenyl)-2-(4-chlorophenyl)-1-oxo-1,2,3,4-tetrahy-dro-isoquinoline-4-carboxylic acid C22H15NO3BrCl 相似度:70% Journal of Heterocyclic Chemistry 2006 43 187-190 A stereoselective three-component reaction: One-pot synthesis of cis-isoquinolonic acids catalyzed by silica sulfuric acid under mild and heterogeneous conditions Javad Azizian,Ali A. Mohammadi,Ebrahim Soleimani,Ali R. Karimi and Mohammad R. Mohammadizadeh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 1-genzyl-2,4,5-triphenylimidazole 相似度:70% Journal of Heterocyclic Chemistry 2002 39 759-765 Novel syntheses of polysubstituted pyrroles and oxazoles by 1,3-dipolar cycloaddition reactions of benzotriazole-stabilized nitrile ylides Alan R. Katritzky, Suoming Zhang, Mingyi Wang, Hartmuth C. Kolb and Peter J. Steel Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . 1-genzyl-2,5-di(4-chlorophenyl)-4-phenyl-1H-imidazole C28H20Cl2N2 相似度:70% Journal of Heterocyclic Chemistry 2002 39 759-765 Novel syntheses of polysubstituted pyrroles and oxazoles by 1,3-dipolar cycloaddition reactions of benzotriazole-stabilized nitrile ylides Alan R. Katritzky, Suoming Zhang, Mingyi Wang, Hartmuth C. Kolb and Peter J. Steel Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . compound 5j 相似度:70% Indian Journal of Chemistry 2008 47B 276-282 An efficient solventless synthesis of α-aryl-N-[1-methyl-2- (2/4-chlorophenyl)] ethyl nitrones and their antimicrobial activity Amutha,Chinnadurai; Saravanan,Sivaperuman; Dhandapani,Perundurai Subramaniam; Muthusubramanian,Shanmugam; Sivasubramanian,Shanmugaperumal Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . 5-(biphen-4-yl)-2,3-diphenyl-1H-pyrrole C28H21N 相似度:70% Indian Journal of Chemistry 2007 46B 1470-1474 Studies in microwave mediated solvent-free synthesis of 5-aryl-2,3- diphenylpyrroles from 4-aryl-1,2-diphenyl-2- butene-1,4-diones Rao,H Surya Prakash; Gorityala,Bala Kishan; Vasantham,K Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . (R)-3,3'-(2,2'-dimethoxy-1,1'-binaphthyl-3,3'-diyl)diquinoline C40H28N2O2 相似度:70% Heterocycles 2009 78 3023-3036 Bifunctional Organocatalyst to Promote the Biginelli Reaction under Mild Conditions Nobuyuki Mase, Daisuke Nakamura, Yasuhiro Kawano, Yuka Suzuki, and Kunihiko Takabe Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . 3-acetyl-2-(triphenylphosphoimino)-1-azaazulene C29H25N2OP 相似度:70% Heterocycles 2007 74 309-320 Synthesis and Reactions of 3-Ethynyl-2-(triphenylphosphoimino)-1-azaazulenes Noritaka Abe, Kentaro Nagamatsu, Tomoyuki Ariyoshi, Hiroyuki Fujii, Yoshiko Murakami, Shoji Tagashira, and Akikazu Kakehi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . (4S,5S)-4-methyl-2-phenyl-5-(1-phenylvinyl)-4,5-dihydrooxazole C18H17NOH 相似度:70% Heterocycles 2006 67 215-232 Tandem Palladium-catalyzed Allene Arylation and Oxazoline Formation Gregory R. Cook* and Wei Xu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . 1-phenethyl-2,4,5-triphenylimidazole C29H24N2 相似度:70% Heterocycles 2004 63 87-93 One-Pot Synthesis of Tetra-substituted Imidazoles on Silica Gel under Microwave Irradiation Yu Xu, Yan-Zhi Liu, Lei Rui, Lei Liu, and Qing-Xiang Guo* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . cis-3-(4-bromophenyl)-2-(4-chlorophenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxlic acid C22H15NO3BrCl 相似度:70% Heterocycles 2004 63 2013-2017 KAl(SO4)2·12H2O: An Efficient Catalyst for the Stereoselective Synthesis of cis-Isoquinolonic Acids Javad Azizian,* Ali A. Mohammadi, Ali R. Karimi, Mohammad R. Mohammadizadeh, and M. Koohshari Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . Compound 11 相似度:70% Magnetic Resonance in Chemistry 2006 44 895-900 1H, 13C and 15N NMR spectral characterization of twenty-seven 1, 2-diaryl-(4E)-arylidene-2-imidazolin-5-ones (pages 895–900) Katri Laihia, Erkki Kolehmainen, Vladimir Nikiforov and Sergei Miltsov Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . Compond 5f 相似度:70% Magnetic Resonance in Chmesitry 2003 41 193-201 1H, 13C, 17O NMR and quantum-chemical study of the stereochemistry of the sulfoxide and sulfone derivatives of 3-arylidene-1-thioflavan-4-one epoxides József Kovács, Gábor Tóth, András Simon, Albert Lévai, Andreas Koch and Erich Kleinpeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . Compond 6a 相似度:70% Magnetic Resonance in Chmesitry 2003 41 193-201 1H, 13C, 17O NMR and quantum-chemical study of the stereochemistry of the sulfoxide and sulfone derivatives of 3-arylidene-1-thioflavan-4-one epoxides József Kovács, Gábor Tóth, András Simon, Albert Lévai, Andreas Koch and Erich Kleinpeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . Compond 6f 相似度:70% Magnetic Resonance in Chmesitry 2003 41 193-201 1H, 13C, 17O NMR and quantum-chemical study of the stereochemistry of the sulfoxide and sulfone derivatives of 3-arylidene-1-thioflavan-4-one epoxides József Kovács, Gábor Tóth, András Simon, Albert Lévai, Andreas Koch and Erich Kleinpeter Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . 1,3,5-Triphenyl-4-parabromobenzoylpyrazole 相似度:70% Tetrahedron Letters 2004 45 4143-4148 Ultrasound-accelerated aromatisation of trans- and cis-pyrazolines under heterogeneous conditions using claycop Siham Mallouk, Khalid Bougrin, Hayat Doua, Rachid Benhida, Mohamed Soufiaoui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . 1,3,4-triphenyl-5-parabromobenzoylpyrazole 相似度:70% Tetrahedron Letters 2004 45 4143-4148 Ultrasound-accelerated aromatisation of trans- and cis-pyrazolines under heterogeneous conditions using claycop Siham Mallouk, Khalid Bougrin, Hayat Doua, Rachid Benhida, Mohamed Soufiaoui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . 1,3,5-Triphenyl-4-parachlorobenzoylpyrazole 相似度:70% Tetrahedron Letters 2004 45 4143-4148 Ultrasound-accelerated aromatisation of trans- and cis-pyrazolines under heterogeneous conditions using claycop Siham Mallouk, Khalid Bougrin, Hayat Doua, Rachid Benhida, Mohamed Soufiaoui Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 48 . 4-(Quinolin-3-yl)benzyl 4-(pyrimidin-5-yl)benzoate 相似度:70% Archiv der Pharmazie 2008 341 478-484 Structural Modifications of Salicylates: Inhibitors of Human CD81-Receptor HCV-E2 Interaction Marcel Holzer, Sigrid Ziegler, Alexander Neugebauer, Bernd Kronenberger, Christian D. Klein and Rolf W. Hartmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 49 . 4,5-Diphenyl-2-nitroaniline C18H14N2O2 相似度:70% Bioorganic & Medicinal Chemistry 2000 8 2591-2600 Topoisomerase I inhibition and cytotoxicity of 5-Bromo- and 5-Phenylterbenzimidazoles Meera Rangarajan, Jung Sun Kim, Sai-Peng Sim, Angela Liu, Leroy F. Liu, Edmond J. LaVoie Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 50 . tert-Butyl (Z)-2-benzoylamino-3-(2-naphthyl)-2-propenoate C24H23NO3 相似度:70% Heterocycles 2011 83 1329-1353 Asymmetric Cyclization Reactions of N-Benzoyl-α-dehydroarylalanine Alkyl Esters via Photoinduced Electron Transfer from Achiral and Chiral Amines Yuji Sasaki, Haruo Watanabe, Tetsutaro Igarashi, and Tadamitsu Sakurai* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 51 . compound 2g C20H16O3 相似度:70% Indian Journal of Chemistry 2011 50B 593-604 Solvent free synthesis, spectral studies and antioxidant activities of some 6-substituted w-bromo-2-naphthyl ketones and their esters Thirunarayanan, G; Vanangamudi, G; Sathiyendran, V; Ravi, K Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 52 . 5-benzoyl-5,11-dihydro-10H-dibenzo[b,f]azepin-10-one C21H15NO2 相似度:70% Journal of Heterocyclic Chemistry 2011 48 856-863 Synthesis and anti-inflammatory activity of 8H-1-thia-8-aza-dibenzo[e,h]azulenes Ivana Ozimec Landek, Dijana Pešić, Mladen Merćep, Barbara Stanić and Milan Mesić Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 53 . 6-Benzoyl-2,7-diphenyl-2,4-dihydro[1,2,3]triazolo[4,5-b]pyridin-5-one C24H16N4O2 相似度:70% Molecules 2011 16 3723-3739 Acylation of Heteroaromatic Amines: Facile and Efficient Synthesis of a New Class of 1,2,3-Triazolo[4,5-b]pyridine and Pyrazolo[4,3-b]pyridine Derivatives Hamada Mohamed Ibrahim, Haider Behbehani, Saad Makhseed and Mohamed H. Elnagdi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 54 . 2-{[2-(2-Naphthylsulfonyl)hydrazono}methyl]phenyl 2-nitrobenzenesulfonate C23H17N3O7S2 相似度:69.5% Molecules 2008 13 11-30 Design and Synthesis of Novel N-Benzylidenesulfonohydrazide Inhibitors of MurC and MurD as Potential Antibacterial Agents Rok Frlan, Andreja Kovač, Didier Blanot, Stanislav Gobec, Slavko Pečar and Aleš Obreza Structure 13C NMR 碳谱模拟图 |
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化合物6 查询结果：共查到4705个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . N-(2-Carbomethoxyphenyl)-2-chloro-3-(naphthalen-2-yl)-but-2(Z)-enamide 相似度:81.8% Bioorganic & Medicinal Chemistry Letters 2003 13 1-4 Inhibition of Telomerase by BIBR 1532 and Related Analogues D. K. Barma, Anissa Elayadi, J. R. Falck and David R. Corey Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . N-(2-Carbomethoxyphenyl)-3-(naphthalen-2-yl)-but-2(E)-enam-ide 相似度:75% Bioorganic & Medicinal Chemistry Letters 2003 13 1-4 Inhibition of Telomerase by BIBR 1532 and Related Analogues D. K. Barma, Anissa Elayadi, J. R. Falck and David R. Corey Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . compound (p,p,s)-2 C22H20O6 相似度:72.7% Tetrahedron Letters 2003 44 3683-3686 Synthesis of optically active bihelicenols Daisuke Nakano, Rie Hirano, Masahiko Yamaguchi, Chizuko Kabuto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . compound 4 C20H15NO2 相似度:72.7% Tetrahedron Letters 2004 45 6265-6268 Synthesis of 5-alkoxymethyl- and 5-aminomethyl-substituted 8-hydroxyquinoline derivatives and their luminescent Al(III) complexes for OLED applications Amaresh Mishra, Pabitra K. Nayak, N. Periasamy Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . N-[4-(Aminosulfonyl)-2-methylphenyl]-2-[1-(3-methylbenzoyl)-2-naphenoxy]acetamide C27H24N2O5S 相似度:70.8% Bioorganic & Medicinal Chemistry 2011 19 4601-4607 Synthesis and biological activity of naphthyl-substituted (B-ring) benzophenone derivatives as novel non-nucleoside HIV-1 reverse transcriptase inhibitors Xiao-Dong Ma, Xuan Zhang, Hui-Fang Dai, Shi-Qiong Yang, Liu-Meng Yang, Shuang-Xi Gu, Yong-Tang Zheng, Qiu-Qin He, Fen-Er Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 7a-azonia-5-thia[6]helicene Hexafluorophosphate C23H14NSPF 相似度:69.5% Journal of Heterocyclic Chemistry 2006 43 177-181 The synthesis of new azoniathiahelicenes Kiyoshi Sato,Yuu Katayama,Takamichi Yamagishi and Sadao Arai Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . serpentene methyl ester C21H22O2 相似度:68.1% Journal of Natural Products 2004 67 1631-1633 Novel Polyene Carboxylic Acids from Streptomyces Silke C. Wenzel, and Helge B. Bode Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . compound 3 C22H22O4 相似度:68.1% Journal of Natural Products 2004 67 1631-1633 Novel Polyene Carboxylic Acids from Streptomyces Silke C. Wenzel, and Helge B. Bode Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . compound 1 C26H16O 相似度:68.1% Molecules 2001 6 442-447 Facile and Fast Pinacol Rearrangement by AlCl3 in the Solid State Parviz Rashidi-Ranjbar and Ebrahim Kianmehr Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . N-[2-(4-chlorophenoxymethyl)-benzoyl]-N'-(2,6-dichlorophenyl)-thiourea C21H17ClN2O2S 相似度:68.1% Molecules 2008 13 567-580 Antimicrobial Activity of Some New Thioureides Derived from 2-(4-Chlorophenoxymethyl)benzoic Acid Carmen Limban, Mariana-Carmen B. Chifiriuc, Alexandru-Vasile Missir, Ileana C. Chiriţă and Coralia Bleotu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 2-[(E)-2-[4-(1H-Benzo[d]triazole-1-yl)phenyl]vinyl]-1,3-benzothiazole-3-oxide 相似度:68.1% Molecules 2009 14 5382-5388 New Conjugated Benzothiazole-N-oxides: Synthesis and Biological Activity Peter Gajdoš, Peter Magdolen, Pavol Zahradník and Pavlína Foltínová Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . Dimethyl-4b,10c-dihydro-benzo[5,6]cyclopropa[1,2-h]naphthalene-4c,10e-dicarboxylate C24H18O4 相似度:68.1% Canadian Journal of Chemistry 2009 87 619-626 Controlling the regioselectivity of the di-p-methane rearrangements of 1,2-naphtho-annelated barrelene derivatives -Solution versus solid-state photochemistry Jia Luo, Heiko Ihmels, Hans-Jo¨ rg Deiseroth, and Marc Schlosser Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . (±)-N-[4-(Aminosulfonyl)-2-methylphenyl]-2-{4-chloro-2-[hydroxyl(2-chlorphenyl)methyl]phenoxyl}acetamide C22H20Cl2N2O5S 相似度:68.1% Bioorganic & Medicinal Chemistry 2011 19 4704-4709 Synthesis and biological evaluation of (±)-benzhydrol derivatives as potent non-nucleoside HIV-1 reverse transcriptase inhibitors Xiao-Dong Ma, Xuan Zhang, Shi-Qiong Yang, Hui-Fang Dai, Liu-Meng Yang, Shuang-Xi Gu, Yong-Tang Zheng, Qiu-Qin He, Fen-Er Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . (±)-N-[4-(Aminosulfonyl)-2-methylphenyl]-2-{4-chloro-2-[hydroxyl(3,4-dichlorophenyl)methyl]phenoxyl}acetamide C22H19Cl3N2O5S 相似度:68.1% Bioorganic & Medicinal Chemistry 2011 19 4704-4709 Synthesis and biological evaluation of (±)-benzhydrol derivatives as potent non-nucleoside HIV-1 reverse transcriptase inhibitors Xiao-Dong Ma, Xuan Zhang, Shi-Qiong Yang, Hui-Fang Dai, Liu-Meng Yang, Shuang-Xi Gu, Yong-Tang Zheng, Qiu-Qin He, Fen-Er Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 11b,12-dihydro-5,11b-thioepoxy[2',1']-naphthaleno-5H-isoindolo[2,1-b]isoquinolin-7-one C26H16NOS 相似度:68.1% Organic letters 2000 2 1201-1204 Formation of New 5,11b-Bridged Isoindolo[2,1-b]isoquinolinones Alkaloids through a Tandem Pummerer/π-Cationic Cyclization Nicolas Hucher, Adam Daich, and Bernard Decroix Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . 2-benzotriazol-1-yl-4-phenylazo-5-thiophen-2-yl-phenol C22H15N5OS 相似度:68.1% Journal of Heterocyclic Chemistry 2003 40 171-175 N-Azolylmethyl ketones as building blocks in heterocyclic synthesis: Synthesis of new polyfunctionally substituted azolylarylazophenols,azolylpyridones and azolylthiophenes Balkis Al-Saleh,Morsy Ahmed El-Apasery,Mervat Mohammed Abdelkhalik and Mohammed Hilmy Elnagdi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . 2-methyl-1-(l-naphthyl)-4,9-dihydro-3H-3,4-carbazoldione 相似度:68.1% Journal of Heterocyclic Chemistry 2003 40 411-417 Synthesis and biological evaluation of structural variants of carbazoquinocin C Alparslan Aygün and Ulf Pindur Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . compound 3h C21H17NO2 相似度:68.1% Heterocycles 2010 80 765-771 Enantioselective Synthesis of 2-Aryl-2,3-dihydro-4-quinolones by Chiral Brønsted Acid Catalyzed Intramolecular Aza-Michael Addition Reaction Zhen Feng, Qing-Long Xu, Li-Xin Dai, and Shu-Li You Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . N-[2-(4-phenyl-1H-imidazol-2-yl)phenyl]benzamide C22H17N3O 相似度:68.1% Heterocycles 2007 71 269-280 The Study of Cyclization of N-Acylphenacyl Anthranilates with Ammonium Salts under Various Conditions Pavel Hradil, Martin Grepl, Jan Hlavac, and Antonin Lycka Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . methyl 3-(2,6-dichlorophenyl)-2-(1,3-diphenyl-3-methoxy-1,3-dihydroisobenzofuran-1-yl)aziridine-2-carboxylate C31H25NO4Cl2 相似度:68.1% Heterocycles 2005 65 1329-1345 Synthesis of 1,3,8,8a-Tetrahydro-3,8-epoxyazirino[1,2-b]isoquinolines and Their Reactions with Oxygen Nucleophiles M. José Alves, * Nuno G. Azoia, and A. Gil Fortes Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . 1-benzyl-2-(4-fluorophenyl)-3-methylpyrrolo[2,3-b]quinoline C25H19N2F 相似度:68.1% Heterocycles 2003 60 1821-1831 A Convenient Diversification of Pyrrolo[2,3-b]quinolines by Iodonation and Palladium-catalyzed Coupling Reactions Won Jung Lee, Moon Bae Gee, and Eul Kgun Yum* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . 3-methyl-1-phenyl-2-vinylpyrrolo[2,3-b]quinoline C20H16N2 相似度:68.1% Heterocycles 2003 60 1821-1831 A Convenient Diversification of Pyrrolo[2,3-b]quinolines by Iodonation and Palladium-catalyzed Coupling Reactions Won Jung Lee, Moon Bae Gee, and Eul Kgun Yum* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . (E)-2-Acetylnaphthalen-1-yl-3-(2-(trifluoromethyl)phenyl)acrylate C22H15F3O3 相似度:68.1% Magnetic Resonance in Chemistry 2010 48 804-810 Synthesis and characterization of 1- and 2-cinnamoyloxyacetonaphthones (pages 804–810) T. K. Venkatachalam, G. K. Pierens and D. C. Reutens Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . (E)-3-Phenyl-2-propenal 1-(benzothiophen-7-ylmethyl)-1-methyl-hydrazone C19H18N2S 相似度:68.1% Pharmazie 2000 55 483-489 L. Auzzas - M. Palomba - G. Boatta - P. Manconi - A. Pau - A. Becciu - R. Cerri - V. Tullio - J. Roana - N. Carlone Antidermatophytic action of new 1-naphthylmethyl and benzothiophen-7-ylmethyl hydrazones related to inhibitors of squalene epoxidase Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . compound (p,p,p)-2 C22H20O6 相似度:68.1% Tetrahedron Letters 2003 44 3683-3686 Synthesis of optically active bihelicenols Daisuke Nakano, Rie Hirano, Masahiko Yamaguchi, Chizuko Kabuto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . compound (E,P*,M*)-6 C22H18O3 相似度:68.1% Tetrahedron Letters 2003 44 3683-3686 Synthesis of optically active bihelicenols Daisuke Nakano, Rie Hirano, Masahiko Yamaguchi, Chizuko Kabuto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . compound 相似度:68.1% Tetrahedron Letters 2003 44 4369-4371 Microwave-assisted multi-component synthesis of fused 3-aminoimidazoles Sarah M. Ireland, Heather Tye, Mark Whittaker Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . (S)-N-(2-Naphthyl)-1-(1-naphthyl)ethylamine C22H19N 相似度:68.1% Tetrahedron Letters 2003 44 8311-8314 A circular dichroism detection of stereostructural change due to amine protonation Marcin Kwit, Jacek Gawronski Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . compound 3f 相似度:68.1% Tetrahedron Letters 2004 45 6141-6146 Synthesis of methyl 9-phenyl-7H-benzocycloheptene-6-carboxylates from Baylis-Hillman adducts: use of intramolecular Friedel-Crafts alkenylation reaction Saravanan GowriSankar, Ka Young Lee, Chang Gon Lee, Jae Nyoung Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . compound 3d C21H17NO4S 相似度:68.1% Tetrahedron Letters 2005 46 4045-4048 A novel synthesis of N-protected carbazoles involving electrocyclization of in situ generated enamines Arasambattu K. Mohanakrishnan, Ramalingam Balamurugan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 5-Methyl-3-(3-phenyl-1H-isochromen-1-yl)-1H-indole C24H19NO 相似度:68.1% Heterocycles 2011 82 1239-1249 Generation of 3-(1H-Isochromen-1-yl)-1H-indole via Silver Triflate-Catalyzed Tandem Reaction of 2-Alkynylbenzaldehyde with Indole Banlai Ouyang, Jianjun Yuan, Qin Yang, Qiuping Ding, Yiyuan Peng,* and Jie Wu* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 5-Methyl-3-(6-methyl-3-phenyl-1H-isochromen-1-yl)-1H-indole C25H21NO 相似度:68.1% Heterocycles 2011 82 1239-1249 Generation of 3-(1H-Isochromen-1-yl)-1H-indole via Silver Triflate-Catalyzed Tandem Reaction of 2-Alkynylbenzaldehyde with Indole Banlai Ouyang, Jianjun Yuan, Qin Yang, Qiuping Ding, Yiyuan Peng,* and Jie Wu* Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . N-(1-Naphthyl)-N'-phenyl-oxaldiimidoylchloride C18H12Cl2N2 相似度:68.1% Zeitschrift für Naturforschung B 2005 60 1192-1196 Synthesis of Unsymmetrical Bis(imidoyl)dichlorides of Oxalic Acid F. Helmholz, R. Schroeder, and P. Langer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . Pyrrolo[2,1-a]isoquinoline-1,2,3-triyltris(phenylmethanone) C33H21NO3 相似度:68.1% Tetrahedron 2012 68 85-91 One-pot multicomponent synthesis of polysubstituted indolizines Zhenjun Mao, Xuejian Li, Xufeng Lin, Ping Lu, Yanguang Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . 1,3-bis(4-chlorophenyl)-9H-thioxanthen-9-one C25H13Cl2OS 相似度:68.1% Tetrahedron 2012 68 711-721 Suzuki–Miyaura reactions of the bis(triflates) of 1,3- and 1,4-dihydroxythioxanthone. Electronic and steric effects on the site-selectivity Dhafer Saber Zinad, Holger Feist, Alexander Villinger, Peter Langer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . 2-[4-(1-Naphthoxymethyl)-3-methylfuran-2-yl]thiophene C20H16O2S 相似度:68.1% Tetrahedron 2012 68 1566-1580 Synthesis of 3-methyl- and 3,4-dimethylfurans using alkoxide, thiolate, and phenoxide-mediated cyclization of 4-oxahepta-1,6-diynes bearing sulfur and selenium functional groups Nami Takahashi, Yuya Nagase, Genzoh Tanabe, Osamu Muraoka, Mitsuhiro Yoshimatsu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . N-(tert-butoxycarbonyl)-(Z)-β-(dibenzothien-4-yl)dehydrophenylalanine C27H25NO4S 相似度:68.1% Bioorganic & Medicinal Chemistry 2008 16 5584-5589 Synthesis of new heteroaryl and heteroannulated indoles from dehydrophenylalanines: Antitumor evaluation Maria-João R.P. Queiroz, Ana S. Abreu, M. Solange D. Carvalho, Paula M.T. Ferreira, Nair Nazareth, M. São-José Nascimento Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . 9,9-dimethyl-6-phenyl-7,8,9,10-tetrahydrobenzo-[c]phenanthridin-7-one C25H21NO 相似度:68.1% Russian Journal of Organic Chemistry 2010 46 1843-1847 Synthesis of new benzo[c]phenanthridine derivatives A. N. Pyrko Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . methyl 3-phenyl-1-(trifluoromethyl)-9H-fluorene-2-carboxylate C22H15F3O2 相似度:68.1% Tetrahedron 2012 68 3654-3668 [3+3] Cyclizations of 1,3-bis(trimethylsilyloxy)-1,3-butadienes—a new approach to diverse CF3-substituted fluorenes, dibenzofurans, 9,10-dihydrophenanthrenes and 6H-benzo[c]chromenes Stefan Büttner, Nazken K. Kelzhanova, Zharylkasyn A. Abilov, Alexander Villinger, Peter Langer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . compound 3a C41H26O 相似度:68.1% Tetrahedron 2012 68 3566-3576 Clathrate formation of Diels–Alder adduct of phencyclone and acenaphthylene. Key role of CH/π and bidentate CH/O interactions of the phenanthrene ring in construction of host framework Masaki Abe, Masashi Eto, Koki Yamaguchi, Masatoshi Yamasaki, Junichi Misaka, Yasuyuki Yoshitake, Masami Otsuka, Kazunobu Harano Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . Compound 14 相似度:68% Magnetic Resonance in Chemistry 2009 47 706-710 1H and 13C NMR signal assignments of some new N, N′-diacyl proflavine derivatives (pages 706–710) Y. Benchabane, G. Boyer and R. Faure Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . 1-anilino-2,3,10-trimethoxycarbonyl-4-methylbenz[a]azulene C27H23NO6 相似度:68% Heterocycles 2001 54 647-665 New Synthetic Approach to Azuleno[1,2-c]pyrroles and Conversion to Benz[a]azulenes Dao-Lin Wang and Kimiaki Imafuku Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . N-[4-(Aminosulfonyl)-2-methylphenyl]-2-[1-(3-chlorobenzoyl)-2-naphenoxy]acetamide C26H21ClN2O5S 相似度:68% Bioorganic & Medicinal Chemistry 2011 19 4601-4607 Synthesis and biological activity of naphthyl-substituted (B-ring) benzophenone derivatives as novel non-nucleoside HIV-1 reverse transcriptase inhibitors Xiao-Dong Ma, Xuan Zhang, Hui-Fang Dai, Shi-Qiong Yang, Liu-Meng Yang, Shuang-Xi Gu, Yong-Tang Zheng, Qiu-Qin He, Fen-Er Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . compound 8 C27H16ClN3O2 相似度:66.6% Tetrahedron Letters 2004 45 4009-4012 Formal [4+2] cycloaddition reactions of N-sulfonyl-2,2'-biindoles: synthesis of indolo[2,3-a]carbazoles and indigo azines Jeffrey T. Kuethe, Ian W. Davies Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . 1-(3-(5-chloro-1H-indol-3-yl)quinoxalin-2-yl)naphthalen-2-ol 相似度:66.6% Bioorganic & Medicinal Chemistry 2012 20 1711-1722 AlCl3 induced (hetero)arylation of 2,3-dichloroquinoxaline: A one-pot synthesis of mono/disubstituted quinoxalines as potential antitubercular agents K. Shiva Kumar, D. Rambabu, Sandhya Sandra, Ravikumar Kapavarapu, G. Rama Krishna, M.V. Basaveswara Rao, Kiranam Chatti, C. Malla Reddy, Parimal Misra, Manojit Pal Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . N-[4-(Aminosulfonyl)-2-methylphenyl]-2-(1-benzoyl-2-naphenoxy)acetamide C26H22N2O5S 相似度:66.6% Bioorganic & Medicinal Chemistry 2011 19 4601-4607 Synthesis and biological activity of naphthyl-substituted (B-ring) benzophenone derivatives as novel non-nucleoside HIV-1 reverse transcriptase inhibitors Xiao-Dong Ma, Xuan Zhang, Hui-Fang Dai, Shi-Qiong Yang, Liu-Meng Yang, Shuang-Xi Gu, Yong-Tang Zheng, Qiu-Qin He, Fen-Er Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . 8-Bromo-3-[benzimidazo(1,2-c)quinazolin-5-yl]-2Hchromene-2-one C23H12BrN3O2 相似度:65.2% Bioorganic & Medicinal Chemistry Letters 2011 21 524-527 3-[Benzimidazo-and 3-[benzothiadiazoleimidazo-(1,2-c)quinazolin-5-yl]-2H-chromene-2-ones as potent antimicrobial agents B. Suresh Kuarm, Y. Thirupathi Reddy, J. Venu Madhav, Peter A. Crooks, B. Rajitha Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 48 . 6,8-dichloro-3-[benzimidazo(1,2-c)quinazolin-5-yl]-2H-chromene-2-one C23H11Cl2N3O2 相似度:65.2% Bioorganic & Medicinal Chemistry Letters 2011 21 524-527 3-[Benzimidazo-and 3-[benzothiadiazoleimidazo-(1,2-c)quinazolin-5-yl]-2H-chromene-2-ones as potent antimicrobial agents B. Suresh Kuarm, Y. Thirupathi Reddy, J. Venu Madhav, Peter A. Crooks, B. Rajitha Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 49 . 3-(4-bromophenyl)-8-methoxy-1-phenyl-5,6,7,8-tetrahydro-1H-benzo[h]pyrazolo[3,4-b]quinoline C27H20BrN3O 相似度:65.2% Journal of Heterocyclic Chemistry 2006 43 1169-1175 A convenient route for the synthesis of pyrazolo[3,4-d]pyrimidine,pyrazolo[3,4-b][1,6]naphthyridine and pyrazolo[3,4-b]quinoline derivatives Madhukar N. Jachak,Appasaheb B. Avhale,Vijay J. Medhane and Raghunath B. Toche Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 50 . (S)-(-)-2-Acetamino-2'-cyano-1,1'-binaphthyl C23H16N2O 相似度:65.2% Zeitschrift für Naturforschung B 2003 58 821-826 Asymmetric Catalysis, 154. New 1,1'-Binaphthyl Ligands for Enantioselective Catalysis H. Brunner, M. Weber, and M. Zabel Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 51 . 12-hydroxy-13-(3,3-dimethyl-3-silabutyn-1-yl)-6-oxa-indeno[1,2-b]phenanthrene C25H22O2Si 相似度:65.2% Heterocycles 2001 54 887-900 Synthesis of Indeno[1,2-b]phenanthrene-Type Heterocycles by Cyclo- aromatization of Acyclic Non-conjugated Benzotetraynes Kazuhiro Miyawaki, Fukuko Ueno, and Ikuo Ueda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 52 . 6-methyl-12-hydroxy-13-93,3-dimethyl-3-silabutyn-1-yl0-6-azaindeno[1,2-b]phenanthrene C26H25NOSi 相似度:65.2% Heterocycles 2001 54 887-900 Synthesis of Indeno[1,2-b]phenanthrene-Type Heterocycles by Cyclo- aromatization of Acyclic Non-conjugated Benzotetraynes Kazuhiro Miyawaki, Fukuko Ueno, and Ikuo Ueda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 53 . 2-(2-methoxycarbonyl-benzoylamino)-4-biphenyl-4-yl-thiophene-3-carboxylic acid isopropyl ester C29H25NO5S 相似度:65.2% Bioorganic & Medicinal Chemistry 2010 18 1773-1782 Novel thiophene derivatives as PTP1B inhibitors with selectivity and cellular activity Deju Ye, Yu Zhang, Fei Wang, Mingfang Zheng, Xu Zhang, Xiaomin Luo, Xu Shen, Hualiang Jiang, Hong Liu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 54 . Diastereoisomer 4a' C26H20ClNO5 相似度:65.2% Helvetica Chimica Acta 2011 94 169-177 Efficient Synthesis of [1, 3]Oxazino[3, 2-f]phenanthridine Derivatives by a Novel 1, 4-Dipolar Cycloaddition Involving a Phenanthridine–Dimethyl Acetylenedicarboxylate Zwitterion and Aromatic Aldehydes Ming Li, Lei Pan and Li-Rong Wen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 55 . compound 6g 相似度:64% Journal of Heterocyclic Chemistry 2009 46 1203-1207 Efficient synthesis of pyrrolo[2,1-a]isoquinoline and pyrrolo[1,2-a]quinoline derivatives in aqueous media Ebrahim Kianmehr,Hamid Estiri and Azadeh Bahreman Structure 13C NMR 碳谱模拟图 |
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