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鄙人忧天木虫 (著名写手)
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[求助]
求助微谱数据 已有1人参与
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碳谱数据输入： 8.5,12.8,18.9,20.4,21.3,25,34.7,35.6,46.2,55.8,57.4,70.4,70.4,72.9,74.4,74.9,75.6,77.12,80.4,83.9,126.6,127.1,127.6,127.7,127.8,129.4,130.9,132.6,133.1,138.1,140.1,165.7,169.4,169.9,172.5,203.2 溶剂为CD3OD。 求助相似度50%以上。 |
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wangkaibo123
荣誉版主 (职业作家)
kerry
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专家经验: +726 - PhEPI: 3
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【答案】应助回帖
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感谢参与，应助指数 +1
鄙人忧天: 金币+20 2014-04-19 14:34:23
感谢参与，应助指数 +1
鄙人忧天: 金币+20 2014-04-19 14:34:23
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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437个化合物(查询结果仅供参考) 1 . 3'-(1-Cyclohexenoyl)-3'-debenzoylpaclitaxel C47H55NO14 相似度:77.5% Bioorganic & Medicinal Chemistry 1999 7 2115-2119 Synthesis and biology of 3′-N-acyl-N-debenzoylpaclitaxel analogues Eun Joo Roh, Choong Eui Song, Deukjoon Kim, Hyun-Ock Pae, Hun-Taeg Chung, Kwan Sun Lee, Ki-byung Chai, Chong Ock Lee, Sang Un Choi Structure 13C NMR 碳谱模拟图 2 . compound 10 C46H47O14N 相似度:71.7% Bioorganic & Medicinal Chemistry 1997 5 941-947 Synthesis and biological activity of A-nor-paclitaxel analogues Mahendra D. Chordia, David G.I. Kingston, Ernest Hamel, Chii M. Lin, Byron H. Long, Craig A. Fairchild, Kathy A. Johnston, William C. Rose Structure 13C NMR 碳谱模拟图 3 . N-de-tert-butoxycarbonyl-N-(4-bromo)-phenylsulfonyl docetaxel C44H48BrNO14S 相似度:71.0% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 4 . 2-debenzoyl-2-tigloyl paclitaxel C45H53NO14 相似度:70.7% Journal of Natural Products 1999 62 219-223 Paclitaxel Analogues from Taxus media cv. Hicksii Bruno Gabetta, Nicola Fuzzati, Paolo Orsini, Federico Peterlongo, Giovanni Appendino, and David G. Vander Velde Structure 13C NMR 碳谱模拟图 5 . 15,16-Dihydro A-nor-paclitaxel C47H51O13N 相似度:70.7% Bioorganic & Medicinal Chemistry 1997 5 941-947 Synthesis and biological activity of A-nor-paclitaxel analogues Mahendra D. Chordia, David G.I. Kingston, Ernest Hamel, Chii M. Lin, Byron H. Long, Craig A. Fairchild, Kathy A. Johnston, William C. Rose Structure 13C NMR 碳谱模拟图 6 . N-debenzoyl-N-butanoyl-10-deacetylpaclitaxel C42H51NO13 相似度:68.4% Phytochemistry 1998 47 1325-1329 Paclitaxel analogues from Taxus baccata Bruno Gabetta, Paolo Orsini, Federico Peterlongo, Giovanni Appendino Structure 13C NMR 碳谱模拟图 7 . N-de-tert-butoxycarbonyl-N-(4-chloro)-phenylsulfonyl docetaxel C44H48ClNO14S 相似度:68.4% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 8 . N-debenzoyl-N-propanoyl-10-deacetylpaclitaxel C41H49NO13 相似度:67.5% Phytochemistry 1998 47 1325-1329 Paclitaxel analogues from Taxus baccata Bruno Gabetta, Paolo Orsini, Federico Peterlongo, Giovanni Appendino Structure 13C NMR 碳谱模拟图 9 . compound 14a C48H52N2O14 相似度:67.5% Journal of Medicinal Chemistry 1995 38 2263-2267 Synthesis and Biological Evaluation of Novel C-4 Aziridine-Bearing Paclitaxel (Taxol) Analogs Shu-Hui Chen, Craig Fairchild, Byron H. Long Structure 13C NMR 碳谱模拟图 10 . N-acetyl-N-debenzoyltaxol C42H49NO14Na 相似度:66.6% Phytochemistry 2000 54 221-230 Taxoids from the needles of the Canadian yew Junzeng Zhang, Francoise Sauriol, Orval Mamer, Lolita O. Zamir Structure 13C NMR 碳谱模拟图 11 . Compound 2 C47H52NO14 相似度:66.6% Bioorganic & Medicinal Chemistry Letters 1998 8 2227-2230 Synthesis of a paclitaxel isomer: C-2-acetoxy-C-4-benzoate paclitaxel Shu-Hui Chen, Vittorio Farina, Dolatrai M. Vyas, Terrence W. Doyle Structure 13C NMR 碳谱模拟图 12 . Compound 2 C47H51NO14 相似度:66.6% Bioorganic & Medicinal Chemistry Letters 1998 8 2227-2230 Synthesis of a paclitaxel isomer: C-2-acetoxy-C-4-benzoate paclitaxel Shu-Hui Chen, Vittorio Farina, Dolatrai M. Vyas, Terrence W. Doyle Structure 13C NMR 碳谱模拟图 13 . N-de-tert-butoxycarbonyl-N-(4-methoxyl)-phenylsulfonyl docetaxel C45H51NO15S 相似度:66.6% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 14 . taxcultine C44H53NO14 相似度:65% Phytochemistry 1996 41 803-805 Isolation and semi-synthesis of a bioactive taxane from Taxus canadensis Lolita Ora Zamir, Maria Elena Nedea, Zhen-Hua Zhou, Gaétan Caron, Françoise Sauriol, Orval Mamer Structure 13C NMR 碳谱模拟图 15 . Taxol 相似度:63.4% Journal of Natural Products 1992 Vol 55 414 1H- and 13C-nmr Assignments for Taxol, 7-epi-Taxol, and Cephalomannine Gwendolyn N. Chmurny, Bruce D. Hilton, Susan Brobst, Sally A. Look, Keith M. Witherup, John A. Beutler Structure 13C NMR 碳谱模拟图 16 . N-de-tert-butoxycarbonyl-N-phenylsulfonyl docetaxel C44H49NO14S 相似度:63.4% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 17 . N-de-tert-butoxycarbonyl-N-(4-trifluoromethyl)-phenylsulfonyl docetaxel C45H48F3NO14S 相似度:63.4% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 18 . 1-deoxypaclitaxel C47H51NO13 相似度:61.1% Journal of Natural Products 2006 69(2) 280-283 1-Deoxypaclitaxel and abeo-Taxoids from the Seeds of Taxus mairei Qing-Wen Shi, Yong-Ming Zhao, Xiao-Tang Si, Zuo-Ping Li, Teiko Yamada, and Hiromasa Kiyota Structure 13C NMR 碳谱模拟图 19 . 13-cinnamoylbaccatin III C40H44O12 相似度:61.1% Chinese Chemical Letters 1998 9 1017-1020 Two New Taxoids from Taxus Yunnanensis Sheng Hong LI,Hong Jie ZHANG,Ping YAO and Han Dong SUN Structure 13C NMR 碳谱模拟图 20 . scutebata A C36H40O10 相似度:61.1% Journal of Natural Products 2010 73 233-236 Cytotoxic Neoclerodane Diterpenoids from Scutellaria barbata Feng Zhu, Ying-Tong Di, Ling-Li Liu, Qiang Zhang, Xin Fang, Ting-Quan Yang, Xiao-Jiang Hao and Hong-Ping He Structure 13C NMR 碳谱模拟图 21 . compound 7 相似度:61.1% Organic Magnetic Resonance 1983 21 257-260 Carbon-13 NMR spectra of taxane-type diterpenes: Oxiranes and oxetanes Anibal C. Rojas, Deanna De Marcano, Bernardo Méndez and Jeannette de Méndez Structure 13C NMR 碳谱模拟图 22 . N-debenzoyl-N-α-methylbutyryl paclitaxel C45H55NO14 相似度:60.9% Journal of Natural Products 1999 62 219-223 Paclitaxel Analogues from Taxus media cv. Hicksii Bruno Gabetta, Nicola Fuzzati, Paolo Orsini, Federico Peterlongo, Giovanni Appendino, and David G. Vander Velde Structure 13C NMR 碳谱模拟图 23 . Cephalomannine 相似度:60.9% Journal of Natural Products 1992 Vol 55 414 1H- and 13C-nmr Assignments for Taxol, 7-epi-Taxol, and Cephalomannine Gwendolyn N. Chmurny, Bruce D. Hilton, Susan Brobst, Sally A. Look, Keith M. Witherup, John A. Beutler Structure 13C NMR 碳谱模拟图 24 . N-de-tert-butoxycarbonyl-N-phenylmethylsulfonyl docetaxel C45H51NO14S 相似度:60.9% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 25 . N-de-tert-butoxycarbonyl-N-(2,4,6-trimethyl)-phenylsulfonyl docetaxel C47H55NO14S 相似度:60.9% Molecules 2013 18 10189-10212 Synthesis and Anti-HBV Activity of Novel 3′-N-phenylsulfonyl Docetaxel Analogs Jun Chang, Yun-Peng Hao, Xiao-Dong Hao, Hong-Fu Lu, Jian-Ming Yu and Xun Sun Structure 13C NMR 碳谱模拟图 26 . Cephalomannine 相似度:60.9% Fitoterapia 2013 90 79-84 Synthesis, isolation, stereostructure and cytotoxicity of paclitaxel analogs from cephalomannine Feng Gao, Dan Wang, Xing Huang Structure 13C NMR 碳谱模拟图 27 . 4-deacetyltaxol C45H49NO13 相似度:60.5% Journal of Medicinal Chemistry 1994 37 4258-4260 4-Deacetyltaxol and 10-Acetyl-4-deacetyltaxotere: Synthesis and Biological Evaluation Apurba Datta, Lalith R. Jayasinghe, Gunda I. Georg Structure 13C NMR 碳谱模拟图 28 . N-debenzoyl-N-butanoyl taxol C44H53NO14 相似度:60% Journal of Natural Products 1994 Vol 57 607 Taxoids from the Roots of Taxus × media cv. Hicksii Giovanni Appendino, Giancarlo Cravotto, Renata Enriù, Pierluigi Gariboldi, Luciano Barboni, Elisabetta Torregiani, Bruno Gabetta, Gianfranco Zini, Ezio Bombardelli Structure 13C NMR 碳谱模拟图 29 . compound 1 相似度:58.9% Acta Pharmaceutica Sinica 1996 31 911-917 SEMISYNTHESIS OF TAxoL O Yue; QC Fang and XT Liang Structure 13C NMR 碳谱模拟图 30 . (3'R)-3'-dephenyl-3',3'-[(1R)-methylethylene]-2'-epi-taxol C44H51NO14 相似度:58.9% European Journal of Organic Chemistry 2005 2005 3962-3972 C-3′-Cyclopropanated Taxol Analogs: Synthesis, Bioassay and Biostructural Analysis Changhui Liu, Markus Tamm, Marcus W. Nötzel, Karsten Rauch, Armin de Meijere, Jennifer K. Schilling, Ami Lakdawala, James P. Snyder, Susan L. Bane, Natasha Shanker, Rudravajhala Ravindra and David G. I. Kingston Structure 13C NMR 碳谱模拟图 31 . 10-deacetyl-10-dehydro-7-acetyltaxol A 相似度:58.5% Phytochemistry 1995 40 1825-1828 Taxanes from Taxus x media Bruno Gabetta, Federico Peterlongo, Gianfranco Zini, Luciano Barboni, Giovanni Rafaiani, Paola Ranzuglia, Elisabetta Torregiani, Giovanni Appendino, Giancarlo Cravotto Structure 13C NMR 碳谱模拟图 32 . 10-去乙酰基巴卡 相似度:58.5% Chinese Traditional and Herbal Drugs 2008 39 1468-1471 朝鲜产东北红豆杉树皮中紫杉烷类成分的研究 刘洋;王继文;雷茂林;赵余庆 Structure 13C NMR 碳谱模拟图 33 . 7-xylose—taxol 相似度:58.5% Chinese Traditional and Herbal Drugs 2008 39 1468-1471 朝鲜产东北红豆杉树皮中紫杉烷类成分的研究 刘洋;王继文;雷茂林;赵余庆 Structure 13C NMR 碳谱模拟图 34 . cephalomannine 相似度:58.5% Journal of Shenyang Pharmaceutical University 2010 27 191-194 Isolation and identification of the taxoids from a callus culture of Taxus cuspidata(2) ZHANG Lin, BAI Jiao, LI Zhan-lin, HUA Hui-ming, SAKAI Jun-ichi, AND OMasayoshi Structure 13C NMR 碳谱模拟图 35 . 13-[N-(p-chlorobenzoyl)-(2'R,3'S)-3'-phenylisoserinate] C47H50ClNO14 相似度:58.5% Journal of Medicinal Chemistry 1992 35 4230-4237 Synthesis of biologically active taxol analogs with modified phenylisoserine side chains Gunda I. Georg, Zacharia S. Cheruvallath, Richard H. Himes, Magdalena R. Mejillano, Charles T. Burke Structure 13C NMR 碳谱模拟图 36 . azidotaxol 相似度:58.5% Journal of Medicinal Chemistry 1994 37 1446-1449 Characterization of Two Taxol Photoaffinity Analogs Bearing Azide and Benzophenone-Related Photoreactive Substituents in the A-Ring Side Chain Charles S. Swindell, Julia M. Heerding, Nancy E. Krauss, Susan Band Horwitz, Srinivasa Rao, Israel Ringel Structure 13C NMR 碳谱模拟图 |
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