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[求助]
求微普解析化合物结构
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化合物1 56.35,76.96,88.34,89.04,112.5,115.25,121.34,129.82,147.21,148.01 溶剂氘代丙酮 化合物2 13.68,15.85,15.98,16.04,22.17,22.47,24.15,26.27,26.49,31.36,39.27,39.45,39.60,69.07,75.31,112.59,115.64,121.21,124.41,124.44,126.30,127.33,134.54,134.62,134.98,145.95,147.76 溶剂氘代氯仿 化合物3 15.69,20.48,20.53,25.33,25.90,25.95,26.65,26.70,28.37,31.22,33.10,34.69,34.73,36.58,36.86,44.10,44.92,50.60,65.79,75.27,88.11 溶剂氘代氯仿 |
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潘宪伟
木虫 (正式写手)
- 应助: 225 (大学生)
- 金币: 3679.1
- 红花: 5
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- 在线: 55.3小时
- 虫号: 1114857
- 注册: 2010-10-06
- 性别: GG
- 专业: 药物分析
【答案】应助回帖
感谢参与，应助指数 +1
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化合物1 1 . prinsepiol 相似度:100% China Journal of Chinese Materia Medica 2011 36 48-56 Aromatic constituents of Heteroplexis microcephala and their bioactivities FAN Xiaona, LIN Sheng, ZHU Chenggen, LIU Yang, HU Jinfeng, CHEN Xiaoguang, WANG Wenjie, CHEN Naihong, SHI Jiangong Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 8,8'-二羟基松脂素 相似度:90% Journal of Shenyang Pharmaceutical University 2006 23 274-276 Chemical constituents of Saussurea lappa C. B Clarke YIN Hong-quan, FU Hong-wei, HUA Hui-ming, PEI Yue-hu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . guaiacylglycerol C10H14O5 相似度:70% Natural Product Research 2007 21 769-774 Water-soluble phenylpropanoid constituents from aerial roots of Ficus microcarpa Ming-An Ouyang; Pei-Qing Chen; Si-Bing Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . erythro-guaiacylglycerol C10H14O5 相似度:70% Natural Product Research 2007 21 769-774 Water-soluble phenylpropanoid constituents from aerial roots of Ficus microcarpa Ming-An Ouyang; Pei-Qing Chen; Si-Bing Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . guaiacylglycerol C10H14O5 相似度:70% Chemical & Pharmaceutical Bulletin 1998 46 655-662 Pharmacologically Active Components of Viticis Fructus (Vitex rotundifolia). II. The Component Having Analgesic Effects Emi OKUYAMA,Shigeru FUJIMORI,Mikio YAMAZAKI and Takeshi DEYAMA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . compound 8 相似度:70% Chemical & Pharmaceutical Bulletin 1998 46 655-662 Pharmacologically Active Components of Viticis Fructus (Vitex rotundifolia). II. The Component Having Analgesic Effects Emi OKUYAMA,Shigeru FUJIMORI,Mikio YAMAZAKI and Takeshi DEYAMA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . guaiacylgycerol C10H14O5 相似度:70% Phytochemistry 1997 45 1679-1682 Phenylpropanoids from leaves of Juniperus phoenicea Gilles Comte, Joseph Vercauteren, Albert J. Chulia, Daovy P. Allais, Christiane Delage Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . prinsepiol C20H22O8 相似度:70% Acta Pharmaceutica Sinica 2004 Vol 39 534-537 Identification of the structure of two new nitro group phenolic glycosides from Schisandra propinqua (Wall.) Baill var. intermidia A.C.Smith WU Tong; KONG De-yun; LI Hui-ting Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . (1'R,2'R)-guaiacyl glycerol 相似度:70% Chemical & Pharmaceutical Bulletin 2002 50 1460-1466 Water-Soluble Constituents of Anise: New Glucosides of Anethole Glycol and Its Related Compounds Toru Ishikawa, Eiko Fujimatu and Junichi Kitajima Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . (1'S,2'R)-guaiacyl glycerol 相似度:70% Chemical & Pharmaceutical Bulletin 2002 50 1460-1466 Water-Soluble Constituents of Anise: New Glucosides of Anethole Glycol and Its Related Compounds Toru Ishikawa, Eiko Fujimatu and Junichi Kitajima Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . threo-1-(4-hydroxy-3-methoxy phenyl)-1,2,3-propanetriol C10H14O5 相似度:70% Chinese Journal of Medicinal Chemistry 2007 17 242-245 Phenolic constituents from Stauntonia chinensis DC. YANG Lei, GAO Hao, WANG Nai-li, YAO Xin-sheng Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . (3R,4R)-3,4-Bis[(S)-(Hydroxy)(4-hydroxy-3-methoxyphenyl) methyl]tetrahydrofuran C20H24O7 相似度:60% Journal of Natural Products 2005 68 1459-1470 Effect of Benzylic Oxygen on the Antioxidant Activity of Phenolic Lignans Satoshi Yamauchi, Yoshimasa Hayashi, Yuki Nakashima,Takuya Kirikihira, Kazuki Yamada, and Toshiya Masuda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . guaiacylglycerol 相似度:60% |
2楼2013-01-11 10:09:02
潘宪伟
木虫 (正式写手)
- 应助: 225 (大学生)
- 金币: 3679.1
- 红花: 5
- 帖子: 708
- 在线: 55.3小时
- 虫号: 1114857
- 注册: 2010-10-06
- 性别: GG
- 专业: 药物分析
【答案】应助回帖
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化合物2 查询结果：共查到239个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 2Z,6E,10E-13-(6-hydroxy-2,8-dimethyl-3,4-dihydro-2H,2-chromenyl)-2,6,10-trimethyl-2,6,10-tridecatrien-1-ol C27H40O3 相似度:92.5% Journal of the Brazilian Chemical Society 2006 17 812-815 A New Biphenyl from Clusia melchiorii and a New Tocotrienol from C. obdeltifolia Josanaide S. R. Teixeira, Luciana de M. Moreira, Maria L. da S. Guedes and Frederico G. Cruz Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . caseamemin C27H40O2 相似度:85.1% Planta Medica 2003 69 667-672 A Cytotoxic Butenolide,Two New Dolabellane Diterpenoids,a Chroman and a Benzoquinol Derivative Formosan Casearia membranacea Keng-Chia Chang,Chang-Yih Duh,Ih-Sheng Chen,Ian-Lih Tsai Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . δ-tocotrienol 相似度:85.1% Bioorganic & Medicinal Chemistry 2011 19 623-630 Cytotoxicity of δ-tocotrienols from Kielmeyera coriacea against cancer cell lines Mariana Laundry de Mesquita, Renata Mendonça Araújo, Daniel Pereira Bezerra, Raimundo Braz Filho,José Elias de Paula, Edilberto Rocha Silveira, Cláudia Pessoa, Manoel Odorico de Moraes,Letícia Veras Costa Lotufo, Laila Salmen Espindola Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . δ-tocotrienol 相似度:85.1% Magnetic Resonance in Chemistry 2008 46 287-294 Assignment of the 1H and 13C NMR of tocotrienols (pages 287–294) Stephan Ohnmacht, Ryan West, Razvan Simionescu and Jeffrey Atkinson Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-6-chromanol 相似度:85.1% Phytochemistry 1983 22 2281-2286 Tocotrienols from Iryanthera grandis Paulo C. Vieira, Orro R. Gottlieb, Hugo E. Gottlieb Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . Parvifoliol F C27H40O2 相似度:85.1% Tetrahedron 2006 62 8578-8585 Phloroglucinols, depsidones and xanthones from the twigs of Garcinia parvifolia Vatcharin Rukachaisirikul, Wanpen Naklue, Souwalak Phongpaichit, Nongporn Hutadilok Towatana, Katesarin Maneenoon Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . sargachromanol B C22H32O3 相似度:81.4% Journal of Natural Products 2005 68 716-723 Chromenes from the Brown Alga Sargassum siliquastrum Kyoung Hwa Jang, Bong Ho Lee, Byoung Wook Choi, Hyi-Seung Lee, and Jongheon Shin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 2,8-Dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl-5-O-[2',8'-dimethyI-2'-(4',8',12'-trimethyl-3',7',11'-tridecatrienyl)-6'-chromanyl)-6-chromanol 相似度:81.4% Phytochemistry 1983 22 2281-2286 Tocotrienols from Iryanthera grandis Paulo C. Vieira, Orro R. Gottlieb, Hugo E. Gottlieb Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . (2R,8'S)-7',8'-dihydro- 9'-oxo-δ-tocotrienol C27H40O3 相似度:77.7% Chemical & Pharmaceutical Bulletin 2008 56(1) 124-128 New Chromane Derivatives Isolated from the Brown Alga, Sargassum micracanthum Makoto IWASHIMA,Natsuko TAKO,Tomoyo HAYAKAWA,Takayuki MATSUNAGA,Jun MORI,d and Haruo SAITO Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . compound 19 C27H40O5 相似度:77.7% Journal of Natural Products 2008 71(10) 1714-1719 Meroditerpenoids from the Brown Alga Sargassum siliquastrum Misong Jung, Kyoung Hwa Jang, Bora Kim, Bong Ho Lee,Byoung Wook Choi, Ki-Bong Oh, and Jongheon Shin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . Tocopherol 相似度:77.7% Acta Botanica Yunnanica 2001 23(4) 515-520 Chemical Constituents from Walsura yunnanensis LUO Xiao-Dong,WU Shao-Hua,MA Yun-Bao,WU Da-Gang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . chrysochlamic acid 相似度:77.7% Journal of the Chemical Society, Perkin Transactions 1 1999 1147-1149 Chrysochlamic acid, a new diterpenoid-substituted quinol from Chrysochlamys ulei that inhibits DNA polymerase β Jing-Zhen Deng, Di-An Sun, Shelley R. Starck, Sidney M. Hecht, Ronald L. Cerny and John R. Engen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . Walsurol C27H40O3 相似度:74.0% Acta Botanica Yunnanica 2001 23(4) 515-520 Chemical Constituents from Walsura yunnanensis LUO Xiao-Dong,WU Shao-Hua,MA Yun-Bao,WU Da-Gang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 9-(3,4-dihydro-6-hydroxy-2,8-dimethy-2H-1-benzopyran-2-yl)-2,6-dimethyl-(6E)-nonenoic acid C22H32O4 相似度:74.0% Chemical & Pharmaceutical Bulletin 2011 59(6) 757-761 Chromanols from Sargassum siliquastrum and Their Antioxidant Activity in HT 1080 Cells Jung Im LEE and Youngwan SEO Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . sargachromanol D 相似度:74.0% Food Chemistry 2010 120 418-425 Sargassum thunbergii extract inhibits MMP-2 and -9 expressions related with ROS scavenging in HT1080 cells Jung-Ae Kim, Chang-Suk Kong, Young-Wan Seo, Se-Kwon Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . δ-tocotrienol 相似度:74.0% Australian Journal of Chemistry 1994 47 587-607 Constituents of Some Species of Beilschmiedia and Endiandra (Lauraceae): New Endiandric Acid and Benzopyran Derivatives Isolated From B. oligandra JE Banfield, DS Black, DJ Collins, BPM Hyland, JJ Lee and SR Pranowo Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . (-)-(E)-2,8-dimethyl-2-(4',8'-dimethyl-3',7'-nonadienyl)-3,4-dihydro-2H-1-benzopyran-6-ol (oligandrol) C22H32O2 相似度:74.0% Australian Journal of Chemistry 1994 47 587-607 Constituents of Some Species of Beilschmiedia and Endiandra (Lauraceae): New Endiandric Acid and Benzopyran Derivatives Isolated From B. oligandra JE Banfield, DS Black, DJ Collins, BPM Hyland, JJ Lee and SR Pranowo Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . Garciniacowol C54H78O4 相似度:74.0% Fitoterapia 2012 83 1430-1434 Antibacterial dihydrobenzopyran and xanthone derivatives from Garcinia cowa stem barks Ittipon Siridechakorn, Wong Phakhodee, Thunwadee Ritthiwigrom, Trinop Promgool, Suwanna Deachathai, Sarot Cheenpracha, Uma Prawat, Surat Laphookhieo Structure 13C NMR 碳谱模拟图 |
3楼2013-01-11 10:09:46
潘宪伟
木虫 (正式写手)
- 应助: 225 (大学生)
- 金币: 3679.1
- 红花: 5
- 帖子: 708
- 在线: 55.3小时
- 虫号: 1114857
- 注册: 2010-10-06
- 性别: GG
- 专业: 药物分析
【答案】应助回帖
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qqzhao: 金币+20, ★★★很有帮助 2013-01-13 11:23:13
qqzhao: 金币+20, ★★★很有帮助 2013-01-13 11:23:13
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化合物3 查询结果：共查到636个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 2β-methoxyclovan-9α-ol 相似度:66.6% Journal of Natural Products 2004 67 793-798 Structure−Activity Relationships in the Fungistatic Activity against Botrytis cinerea of Clovanes Modified on Ring C Athina Deligeorgopoulou, Antonio J. Macas-Snchez, Daniel J.Mobbs, Peter B. Hitchcock, James R. Hanson, and Isidro G. Collado Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 9α-hydroxy-2β-methoxyclovane 相似度:66.6% Phytochemistry 1999 52 631-634 The microbiological hydroxylation of some 2,9-dioxygenated clovanes by Mucor plumbeus Simone Fontes Arantes, James R. Hanson, Daniel J. Mobbs Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . sesquiterpene 相似度:66.6% Phytochemistry 1997 45 343-347 Sesquiterpenoids from Euphorbia wangii Jian-Gong Shi, Yan-Ping Shi, Zhong-Jian Jia Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . (1S,2S,5S,8R,9R)-2-methoxy-9-clovanol C16H28O2 相似度:66.6% Phytochemistry 1990 29 757-763 Rearranged caryophyllenes by biotransformation with Chaetomium cochliodes Wolf-Rainer Abraham,Ludger Ernst,Hans-Adolf Arfmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . (3S,3aS,6R,7R,9aS)-N-(6-hydroxy-1,1,7-trimethyldecahydro-3a,7-methanocyclopentacyclooct-3-yl)acetamide C17H29NO2 相似度:66.6% Russian Journal of Organic Chemistry 2004 40 1593-1598 Reactions of caryophyllene, isocaryophyllene, and their epoxy derivatives with acetonitrile under ritter reaction conditions O. I. Yarovaya, D. V. Korchagina, T. V. Rybalova, Yu. V. Gatilov and M. P. Polovinka, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 5β-Pragnane-3β,20-diol C21H36O2 相似度:66.6% Organic Magnetic Resonance 1977 9 439-464 13C N.m.r. Spectra of steroids—A Survey and Commentary J.W.Blunt and J.B.Stothers Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . 3β-Hydroxy-5β-pregn-16-en-20-one C21H32O2 相似度:66.6% Organic Magnetic Resonance 1977 9 439-464 13C N.m.r. Spectra of steroids—A Survey and Commentary J.W.Blunt and J.B.Stothers Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . (1S,3Z,7S,8S,11S,12S)-(+)-7,8-epoxyverticill-3-en-12,20-diol 20-acetate C22H36O4 相似度:63.6% Phytochemistry 2008 69 2844-2848 Oxygenated verticillene derivatives from Bursera suntui Hugo A. García-Gutiérrez, Carlos M. Cerda-García-Rojas, Juan D. Hernández-Hernández,Luisa U. Román-Marín, Pedro Joseph-Nathan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 16-Methyl-3β-acetoxy-5α-androstan-17-ol 7b C22H36O3 相似度:63.6% Steroids 2001 66 833-843 Configurational analysis and relative binding affinities of 16-methyl-5α-androstane derivatives Pál Tapolcsányi, János Wölfling, István Tóth, Mihály Szécsi, Péter Forgó, Gyula Schneider Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . (R)-3-Methyl-2-{[(S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl}butan-1-ol and (R)-3-Methyl-2-{[(R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl}butan-1-ol C11H22O3 相似度:63.6% Organic Letters 2010 Vol.12,No.5 904-907 Total Synthesis of 10-Isocyano-4-cadinene and Determination of Its Absolute Configuration Keisuke Nishikawa, Hiroshi Nakahara, Yousuke Shirokura, Yasuyuki Nogata,Erina Yoshimura, Taiki Umezawa, Tatsufumi Okino, and Fuyuhiko Matsuda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . (2R)-2-((2,2-dimethyl-1,3-dioxolan-4-yl)methyl)-3-methylbutan-1-ol C11H22O3 相似度:63.6% The Journal of Organic Chemistry 2011 76 6558-6573 Total Synthesis of 10-Isocyano-4-cadinene and Its Stereoisomers and Evaluations of Antifouling Activities Keisuke Nishikawa, Hiroshi Nakahara, Yousuke Shirokura, Yasuyuki Nogata, Erina Yoshimura,Taiki Umezawa, Tatsufumi Okino, and Fuyuhiko Matsuda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 19-O-deethylspiramine N C20H29NO3 相似度:61.9% Chinese Chemical Letters 2001 12 147-150 New Diterpenoid Alkaloids from Spiraea japonica var. ovalifolia Guo Ying ZUO, Hong Ping HE, Xin HONG, Wei Ming ZHU, Yi Ming HU, Xiao Sheng YANG, Xiao Jiang HAO Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 16-Methyl-17-acetoxy-5α-androstan-3β-ol 7c C22H36O3 相似度:61.9% Steroids 2001 66 833-843 Configurational analysis and relative binding affinities of 16-methyl-5α-androstane derivatives Pál Tapolcsányi, János Wölfling, István Tóth, Mihály Szécsi, Péter Forgó, Gyula Schneider Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . (1S,2S,5S,8R,9R)-2-acetoxy-9-clovanol C17H28O3 相似度:61.9% Phytochemistry 1990 29 757-763 Rearranged caryophyllenes by biotransformation with Chaetomium cochliodes Wolf-Rainer Abraham,Ludger Ernst,Hans-Adolf Arfmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . diethyl 7-dodecyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydroisobenzofuran-4-ylphosphonate C24H41O6P 相似度:61.9% Heterocycles 2010 82 417-429 Isomerization of Diethyl 1-Alkynylphosphonates to 1,3-Dienylphosphonates Followed by Diels-Alder Reaction with Dead, Maleic Anhydride and Maleimide Abdullatif Azab, Abed Al Aziz Quntar, Tamar Antebi, and Morris Srebnik Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . Compound 11 相似度:61.9% Bioorganic & Medicinal Chemistry Letters 2006 16 1227-1230 Antiangiogenic activity of deoxoartemisinin derivatives on chorioallantoic membrane Mankil Jung, Jungae Tak, Won-Yoon Chung, Kwang-Kyun Park Structure 13C NMR 碳谱模拟图 |
4楼2013-01-11 10:10:33