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mikewindy木虫 (初入文坛)
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[求助]
化合物C谱微谱求助
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DMSO，C谱数据如下： 19.5,20.1,22.0,22.9,29.0,29.1,32.7,35.1,39.8,41.3,62.9,71.0,75.6,76.6,77.0,80.3,96.8,115.5,126.9,136.9,143.3； 希望能给出相似度大于50%的结果参考，多谢！ |
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lifeliuyan
至尊木虫 (职业作家)
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【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
辣笔v小新: 金币+2, 鼓励应助 2013-12-04 22:50:09
mikewindy: 金币+20, ★★★很有帮助, 多谢回复！ 2013-12-05 22:47:13
感谢参与，应助指数 +1
辣笔v小新: 金币+2, 鼓励应助 2013-12-04 22:50:09
mikewindy: 金币+20, ★★★很有帮助, 多谢回复！ 2013-12-05 22:47:13
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查询结果：共查到227个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 3-β-hydroxyartemisinic acid β-D-glucopyranosyl ester 相似度:66.6% Phytochemistry 1998 48 1329-1333 Biotransformation of artemisinic acid by cultured cells of Artemisia annua Hiroshi Kawamoto, Yoshihisa Asada, Hiroshi Sekine, Tsutomu Furuya Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . platanionoside J C19H34H7 相似度:61.9% Chemical & Pharmaceutical Bulletin 2002 50(3) 390-394 Platanionosides D—J: Megastigmane Glycosides from the Leaves of Alangium platanifolium (SIEB. et ZUCC.) HARMS var. platanifolium SIEB. et ZUCC. Hideaki OTSUKA and Akie TAMAKI Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . 14,15-dihydrohistelosamide C21H29N3O8 相似度:61.9% Journal of Natural Products 2002 65 649-655 Investigation of Pictet-Spengler Type Reactions of Secologanin with Histamine and Its Benzyl Derivative Gyula Beke, László F. Szabó, and Benjamin Podányi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . scutebarbatine W C33H37NO8 相似度:61.9% Chemical & Pharmaceutical Bulletin 2010 58 1267-1270 Scutebarbatines W—Z, New neo-Clerodane Diterpenoids from Scutellaria barbata and Structure Revision of a Series of 13-Spiro neo-Clerodanes Fei Wang, Fu-Cai Ren, Ya-Ju Li and Ji-Kai Liu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . kalihinols A 相似度:61.9% Archives of Pharmacal Research 2009 32 1581-1584 A new kalihinol diterpene from the Hainan sponge Acanthella sp. Ji-Zheng Sun, Kao-Shan Chen, Li-gong Yao, Hai-Li Liu and Yue-Wei Guo Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . compound 5 C21H32O10 相似度:61.9% Phytochemistry Letters 2012 5 729-733 New sesquiterpene lactone glucosides from the roots of Ferula varia Shin-ichiro Kurimoto, Kyoko Suzuki, Mamoru Okasaka, Yoshiki Kashiwada, Olimjon K. Kodzhimatov, Yoshihisa Takaishi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . Kalihinol A C22H33N2O2Cl 相似度:61.9% Journal of the American Chemical Society 1987 109 6119-6123 Kalihinols, multifunctional diterpenoid antibiotics from marine sponges Acanthella spp Clifford W. J. Chang, Amarendra Patra, Jill A. Baker, Paul J. Scheuer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . kalihiolA 相似度:59.0% Natural Product Research and Development 2003 15 199-202 STUDIES ON THE CHEMICAL CONSTITUENTS OF MARINE SPONGE ACANTHELLASP.FROM THE SOUTH CHINA SEA YAN Xiao-hong; SONG Guo-qiang; ZHOU Xiu-hong; LIU Song-bai; GUO Yue-wei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . kalihinol-E 相似度:59.0% Tetrahedron 1996 52 2359-2368 Terpenoids with antifouling activity against barnacle larvae from the marine sponge Acanthella cavernosa Hiroshi Hirota, Yasuhiko Tomono, Nobuhiro Fusetani Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . (-)-β-D-18–Glucopiranosyl-9,15-dihydroxy Kaurenoate 相似度:57.6% Molecules 1999 4 M92 (-)-b-D-18–Glucopiranosyl-9, 15-dihydroxy Kaurenoate, a ewDiterpene Glycoside from Ageratina vacciniaefolia Rubén Torrenegra, Jorge Robles, Julio Pedrozo and Beatriz Pescador Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . comound 18 相似度:57.1% Journal of Natural Products 2004 67 64-69 The Microbiological Transformation of Two 15β-Hydroxy-ent-kaurene Diterpenes by Gibberella fujikuroi Braulio M. Fraga, Ricardo Guillermo, and Melchor G. Hernndez Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . nuapapuin A 相似度:57.1% Journal of Natural Products 1998 61 241-247 Isolation and Cytotoxic Evaluation of Marine Sponge-Derived Norterpene Peroxides Sam Sperry, Frederick A. Valeriote, Thomas H. Corbett, and Phillip Crews Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . pterodontoside D C21H38O7 相似度:57.1% Journal of Natural Products 1997 60 545-549 Eleven New Eudesmane Derivatives from Laggera pterodonta Yu Zhao, Jian-Min Yue, Yi-Neng He, Zhong-Wen Lin, and Han-Dong Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 12-O-methylcandesalvone B C21H28O6 相似度:57.1% Planta Medica 2003 69 254-257 New Diterpenoids from the Aerial Parts of Salvia candelabrum Judit Hohmann,Gábor Janicsák,Peter Forgo,Dóra Rédei,Imre Máthé,Tibor Bartók Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . agallochin C C20H35O3Cl 相似度:57.1% Phytochemistry 2000 55 891-901 Five diterpenoids (agallochins A-E) from the mangrove plant Excoecaria agallocha Linn Ammanamanchi S.R. Anjaneyulu , Vadali Lakshmana Rao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . pterodontoside D 相似度:57.1% Chinese Chemical Letters 1996 7 1093-1094 EUDESMANES AND EUDESMANOIC GLUCOSIDES FROM LAGGERA PETERODONTA YU ZHAO,JIAN MIN YUE,JING KAI DING,ZHONG WEN LIN AND HAN DONG SUN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . 3α,4β-dihydroxy-15,16-epoxy-19-nor-12-oxo-cleroda-5(10),13(16),14-triene C19H26O4 相似度:57.1% Phytochemistry 1997 45 379-381 Clerodane diterpenes of Croton hovarum Hans C. Krebs, Harisolo Ramiarantsoa Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . 5-epi-brussonol C22H32O3 相似度:57.1% Organic Letters 2007 Vol. 9, No. 14 2705-2708 Reconciling Icetexane Biosynthetic Connections with Their Chemical Synthesis: Total Synthesis of (±)-5,6-Dihydro-6r-hydroxysalviasperanol,(±)-Brussonol, and (±)-Abrotanone Eric M. Simmons, Jennifer R. Yen, and Richmond Sarpong Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . Compound 1 C20H30O4 相似度:57.1% Bioorganic & Medicinal Chemistry Letters 2009 19 5727-5731 Bioactivity-guided isolation of cytotoxic constituents from stem–bark of Premna tomentosa A. Hymavathi, K. Suresh Babu, V.G.M. Naidu, S. Rama Krishna, Prakash V. Diwan, J. Madhusudana Rao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . Compound 2 C20H30O3 相似度:57.1% Bioorganic & Medicinal Chemistry Letters 2009 19 5727-5731 Bioactivity-guided isolation of cytotoxic constituents from stem–bark of Premna tomentosa A. Hymavathi, K. Suresh Babu, V.G.M. Naidu, S. Rama Krishna, Prakash V. Diwan, J. Madhusudana Rao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . Jasminoside M C21H34O11 相似度:57.1% Helvetica Chimica Acta 2010 93 763-771 Monoterpenoids from the Fruit of Gardenia jasminoides Yang Yu, Hao Gao, Yi Dai, Ying Wang, He-Ru Chen and Xin-Sheng Yao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . Compound 1e 相似度:57.1% Magnetic Resonance in Chemistry 2006 44 651-653 Complete assignments of the 1H and 13C NMR spectra of 9, 10-didehydro retinoic acids (pages 651–653) J. Thibonnet, A. Duchêne, J.-L. Parrain and M. Abarbri Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . Daucuside C21H36O9 相似度:57.1% Fitoterapia 2010 81 443-446 Two new guaiane-type sesquiterpenoids from the fruits of Daucus carota L. Hong-wei Fu, Lin Zhang, Tao Yi, Yu-lin Feng, Jing-kui Tian Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . Pseudolarkaemin B C21H32O11 相似度:57.1% Planta Medica 2011 77 1924-1931 Antimicrobial, Cytotoxic Lignans and Terpenoids from the Twigs of Pseudolarix kaempferi He, Wen-Jun; Chu, Hong-Biao; Zhang, Yu-Mei; Han, Hong-Jin; Yan, He; Zeng, Guang-Zhi; Fu, Zhao-Hui; Olubanke, Ogunlana; Tan, Ning-Hua: Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . (6S,9S)-9-(4',6'-O-isopropylidene-β-D-glucopyranosyl)oxy-6-hydroxy-3-oxo-α-ionol C22H34O8 相似度:57.1% Bioorganic & Medicinal Chemistry 2009 17 189-194 A simple synthesis of four stereoisomers of roseoside and their inhibitory activity on leukotriene release from mice bone marrow-derived cultured mast cells Arata Yajima, Yutaka Oono, Ryusuke Nakagawa, Tomoo Nukada, Goro Yabuta Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . epoxyactinidionoside 相似度:57.1% Natural Product Research and Development 2002 14(1) 9-12 STUDY ON THE CHEMICAL CONSTITUENTS OF LYCHNIS CORONARIA DAI Hao-fu; LIU Yu-qing; DENG Shi-ming; TAN Ning-hua; ZHOU Jun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . (-)-4-[(4aS,8aS)-2,5,5,8a-tetramethyl-4a,5,6,7,8,8a-hexahydro-1-naphthalenyl]-2-methyl-2-butanol C19H32O 相似度:57.1% Tetrahedron 2002 58 5275-5285 The synthesis of Ambra oxide related compounds starting from (+)-larixol. Part 3 Marjon G Bolster, Ben J.M Jansen, Aede de Groot Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . (3RS,3aSR,4SR,5SR,7aSR)-3a,7,7-trimethyl-1-oxo-3-phenyloctahydro-1H-indene-4,5-diyl diacetate C22H28O5 相似度:57.1% Bioorganic & Medicinal Chemistry 2009 17 1152-1157 Function-oriented synthesis applied to the anti-botulinum natural product toosendanin Yuya Nakai, William H. Tepp, Tobin J. Dickerson, Eric A. Johnson, Kim D. Janda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . phlomuroside 相似度:57.1% Turkish Journal of Chemistry 2003 27 703-711 Phenolic, Megastigmane, Nucleotide, Acetophenon and Monoterpene Glycosides from Phlomis samia and P. carica FUNDA NURAY YALÇIN, TAYFUN ERSÖZ, PINAR AKBAY, İHSAN ÇALIŞ, ALİ ARSLAN DÖNMEZ, OTTO STICHER Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . compound 8 C21H32O9 相似度:57.1% Phytochemistry Letters 2012 5 729-733 New sesquiterpene lactone glucosides from the roots of Ferula varia Shin-ichiro Kurimoto, Kyoko Suzuki, Mamoru Okasaka, Yoshiki Kashiwada, Olimjon K. Kodzhimatov, Yoshihisa Takaishi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . compound 64' 相似度:57.1% Tetrahedron 2013 69 5205-5220 Total syntheses of the squalene-derived halogenated polyethers ent-dioxepandehydrothyrsiferol and armatol A via bromonium- and Lewis acid-initiated epoxide-opening cascades Brian S. Underwood, Jessica Tanuwidjaja, Sze-Sze Ng, Timothy F. Jamison Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . 3α,4β-Dihydroxy-15,16-epoxy-12-oxo-19-nor-cleroda-5(10),13(16),14-triene 相似度:57.1% Natural Product Communications 2006 1 319-336 Clerodane Diterpenes from Croton Species: Distribution anda Compilation of their 13C NMR Spectral Data Sebastião F. Palmeira Júnior, Lucia M. Conserva and José Maria Barbosa Filho Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . Kalihinol E C22H33N2O2Cl 相似度:57.1% Journal of the American Chemical Society 1987 109 6119-6123 Kalihinols, multifunctional diterpenoid antibiotics from marine sponges Acanthella spp Clifford W. J. Chang, Amarendra Patra, Jill A. Baker, Paul J. Scheuer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . eriocalyxin C C22H28O7 相似度:54.5% Journal of Natural Products 1999 62 782-784 Diterpenoids from Isodon eriocalyx Shao-Nong Chen, Jian-Min Yue, Shao-Yuan Chen, Zhong-Wen Lin, Guo-Wei Qin, Han-Dong Sun, and Yao-Zu Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . eriocalyxin C C22H28O7 相似度:54.5% Chinese Chemical Letters 1998 9 1025-1028 Three New Diterpenoids from Isodon Eriocalyx shao Nong CHEN,Shao Yuan CHEN,Jian Min YUE,Zhong Wen LIN,Guo Wei QIN,Han Dong SUN,and Yao Zu CHEN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . epi-macoecrystal P C21H28O6 相似度:54.5% Chinese Chemical Letters 1999 10 31-32 Two new diterpenoids from Isodon eriocalyx Neng Yu CHEN, Min Qing TIANand Rui WU, Han Dong SUN, Chao Ming LI Zhong Wen LIN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . 11,12-di-O-methylcarnosol 相似度:54.5% Phytochemistry 1994 35 1373-1374 Diterpenes from the aerial part of Salvia columbariae Javier G. Luis, Winston Quiñones, Teresa A. Grillo, Martha P. Kishi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . Stemocurtisinol N-Oxide C22H31NO7 相似度:54.5% Journal of Natural Products 2010 73 1833-1838 Phytochemical Investigations of Stemona curtisii and Synthetic Studies on Stemocurtisine Alkaloids Sukanda Chaiyong, Araya Jatisatienr, Pitchaya Mungkornasawakul, Thanapat Sastraruji, Stephen G. Pyne, Alison T. Ung, Thitima Urathamakul, and Wilford Lie Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . 12-O-methylcandesalvone B methyl ester C22H30O6 相似度:54.5% Phytochemistry 1989 28 1685-1690 Diterpenoids from Salvia candelabrum Eduarda Mendes,José L. Marco,Benjamin Rodríguez,María L. Jimeno,Ana M. Lobo,Sundaresan Prabhakar Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . daucosterol-6'-O-stearate 相似度:54.5% Natural Product Research and Development 1996 8(1) 5-9 THE CONSTITUENTS FROM THE RHIZOMA OF ALTSMA ORIENTALIS (SAM) JUZEP. Cai Lining; Wang Hongshu; Cao Hongxing; Zhang Ruyi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . 3α,20α-epoxy-ent-kaur-16-ene-l,7-dione 相似度:54.5% Journal of the Chinese Chemical Society 2000 47 363-366 Diterpenoids from Isodon eriocalyx Neng-Yu Chen*, Min-Qing Tian, Rui Wu,Han-Dong Sun, Chao-Ming Li and Zhong-Wen Lin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . jasminoside S C22H36O12 相似度:54.5% Bioorganic & Medicinal Chemistry Letters 2013 23 1127-1131 Chemical constituents from the fruit of Gardenia jasminoides and their inhibitory effects on nitric oxide production Kaifeng Peng, Liguo Yang, Shizhe Zhao, Lixia Chen, Feng Zhao, Feng Qiu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . 11,12-di-O-methylcarnosol 相似度:54.5% Pharmaceutica Acta Helvetiae 1997 72 233-238 Abietane diterpenoids from Salvia rubescens ssp. truxillensis J.Manuel Amaro-Luis Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . β-gentiobiosyl 2,6,6-trimethylcyclohex-1-ene-1-carboxylate C22H36O12 相似度:54.5% Chemistry & Biodiversity 2012 9 1490-1499 Melanogenesis Inhibitory Activity of Monoterpene Glycosides from Gardeniae Fructus Toshihiro Akihisa, Kensuke Watanabe, Ayako Yamamoto, Jie Zhang, Masahiro Matsumoto and Makoto Fukatsu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . (-)-muqubilin A C24H38O4 相似度:54.1% Journal of Natural Products 1998 61 241-247 Isolation and Cytotoxic Evaluation of Marine Sponge-Derived Norterpene Peroxides Sam Sperry, Frederick A. Valeriote, Thomas H. Corbett, and Phillip Crews Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . 2α,5α-diacetoxy-13β-hydroxy-taxa-4(20),12(18)-diene C24H36O5 相似度:54.1% Tetrahedron 2008 64 8102-8116 Structural diversification of taxanes by whole-cell biotransformation Jungui Dai, Runjiang Qu, Jian-hua Zou, Xiaoguang Chen Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . (-)-9,10-epoxymuqubilin A C24H40O5 相似度:54.1% Journal of Natural Products 2013 76 1541-1547 In Vitro Pharmacological and Toxicological Effects of Norterpene Peroxides Isolated from the Red Sea Sponge Diacarnus erythraeanus on Normal and Cancer Cells Florence Lefranc, Genoveffa Nuzzo, Nehal Aly Hamdy, Issa Fakhr, Laetitia Moreno Y Banuls, Gwendoline Van Goietsenoven, Guido Villani, Véronique Mathieu, Rob van Soest, Robert Kiss, and Maria Letizia Ciavatta Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 48 . Laciniatiin C26H38O8 相似度:53.8% Natural Product Communications 2008 3 873-876 Furanolabdane Diterpene Glycosides fromEremostachys laciniata Abbas Delazar, Masoud Modarresi, Hossein Nazemiyeh, Fatemeh Fathi-Azad,Lutfun Nahar and Satyajit D. Sarker Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 49 . curcumrinol A C20H32O3 相似度:52.3% Helvetica Chimica Acta 2008 Vol. 91 944 Cytotoxic Diterpenes from the Root Tuber of Curcuma wenyujin Wei Huang, Peng Zhang, Ye-Cheng Jin, Qiang Shi, Yi-Yu Cheng, Hai-Bin Qu, and Zhong-Jun Ma Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 50 . staphylionoside B C19H34O9 相似度:52.3% Chemical & Pharmaceutical Bulletin 2005 53(7) 800-807 Staphylionosides A—K: Megastigmane Glucosides from the Leaves of Staphylea bumalda DC. Qian YU,Katsuyoshi MATSUNAMI,Hideaki OTSUKA,and Yoshio TAKEDA Structure 13C NMR 碳谱模拟图 |
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