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急求微谱数据库查询

作者 heroqe
来源: 小木虫 150 3 举报帖子
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碳谱数据:150.5,149.7,147.5,136.6,135.1,134.2,127.2,125.39,122.1,119.9,118.7,109.8,108.6,61.2,55.6,53.5,37.7,37.3,23.1,19.1
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今日热帖
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  • heroqe

    引用回帖:
    2楼: Originally posted by fengxue01 at 2012-04-06 10:51:50:
    试试看看

    试出来没?

  • 小曼1211

    查询结果:共查到428个化合物(查询结果仅供参考)  
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    1 .     3,14-dihydrodecussine
        相似度:100%
    Journal of Natural Products          1981          Vol 44          415-421
    Some New Decussine-Type Alkaloids From Strychnos decussata, Strychnos dale and Strychnos elaecocarpa
    Wenche N. A. Rolfsen, Ajibola A. Olaniyi, Robert Verpoorte, Lars Bohlin
    Structure      13C NMR   碳谱模拟图

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    2 .     akagerine
    C20H24N2O2     相似度:70%
    Phytochemistry          2001          57          653-659
    Main glucosidase conversion products of the gluco-alkaloids dolichantoside and palicoside
    Viviane Brandt, Monique Tits, Jacques Penelle, Michel Frédérich, Luc Angenot
    Structure      13C NMR   碳谱模拟图

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    3 .     3-Bromo-4,4',5-trimethoxy-4'-O-tert-butyldiphenylsilyl-E-isomer
        相似度:61.9%
    Journal of Natural Products          2005          68          1450-1458
    Antineoplastic Agents. 509. Synthesis of Fluorcombstatin Phosphate and Related 3-Halostilbenes
    George R. Pettit, Mathew D. Minardi, Heidi J. Rosenberg, Ernest Hamel, Michael C. Bibby, Sandie W. Martin, M. Katherine Jung, Robin K. Pettit, Timothy J. Cuthbertson, and Jean-Charles Chapuis
    Structure      13C NMR   碳谱模拟图

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    4 .     α-yohimbine
    C21H27N2O3     相似度:61.9%
    Planta Medica          2000          66          531-536
    Leishmanicidal,Antiplasmodial and Cytotoxic Activity of Indole Alkaloids from Corynanthe pachyceras
    Dan Stærk,Else Lemmich,Jette Christensen, Arsalan Kharazmi,Carl Erik Olsen,Jerzy W.Jaroszewski
    Structure      13C NMR   碳谱模拟图

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    5 .     α-yohimbine
    C21H26N203     相似度:61.9%
    Chemistry of Natural Compounds          1996          32          386-512
    ALKALOIDS. PLANTS, STRUCTURES, PROPERTIES CHAPTER , continued
    R. Shakirov, M. V. Telezhenetskaya, I. A. Bessonova,S. F. Aripova, I. A. Israilov, M. N. Suitankhodzhaev,V. I. Vinogradova, V. I. Akhmedzhanova, T. S. Tulyaganov,B. T. Salimov, and V. A. Tel'nov
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    6 .     7,8-dimethoxy-3',4'-methylenedioxyflavone
    C18H14O6     相似度:60%
    Chemical & Pharmaceutical Bulletin          2002          50(9)          1271-1272
    Two New 5-Deoxyflavones from Albizia odoratissima
    Yerra KOTESWARA RAO,Mopur VIJAYA BHASKAR REDDY,Chunduri VENKATA RAO, Duvvuru GUNASEKAR,a Alan BLOND, Cristelle CAUX,and Bernard BODO
    Structure      13C NMR   碳谱模拟图

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    7 .     multicaulin
    C20H22O     相似度:60%
    Journal of Natural Products          1997          60          1275-1280
    Norditerpenoids and Diterpenoids from Salvia multicaulis with Antituberculous Activity
    Ayhan Ulubelen, Gülaçtì Topcu, and Candan Bozok Johansson
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    8 .     borrerine
        相似度:60%
    Journal of Natural Products          1985          Vol 48          120-123
    RMN du Carbone 13 des Alcaloïdes du Type Borrérine-Borrévérine-Isoborrévérine
    F. Tillequin, M. Koch, A. Rabaron
    Structure      13C NMR   碳谱模拟图

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    9 .     2-(4-(2,3,4-Tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butyl)isoindoline 1,3-dione
    C23H23N3O2     相似度:60%
    Journal of Natural Products          2011          74          1972-1979
    Antimalarial β-Carbolines from the New Zealand Ascidian Pseudodistoma opacum
    Susanna T. S. Chan, A. Norrie Pearce, Michael J. Page, Marcel Kaiser, and Brent R. Copp
    Structure      13C NMR   碳谱模拟图

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    10 .     (3R,12bS)-methyl (3-ethyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl)acetate
    C20H26O2N2     相似度:60%
    Heterocycles          2010          81          1791-1798
    Formal Syntheses of Dihydrocorynantheine and Isorhynchophylline via Proline Catalyzed Mannich-Michael Reaction
    Kazuhiro Nagata, Hitomi Ishikawa, Ayako Tanaka, Michiko Miyazaki, Takuya Kanemitsu, and Takashi Itoh
    Structure      13C NMR   碳谱模拟图

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    11 .     Magnoflorine
        相似度:60%
    Archives of Pharmacal Research          2008          31          1405-1412
    Inhibitory activities of the alkaloids from Coptidis Rhizoma against aldose reductase
    Hyun Ah Jung, Na Young Yoon, Hyun Ju Bae, Byung-Sun Min and Jae Sue Choi
    Structure      13C NMR   碳谱模拟图

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    12 .     N-(3-(1H-imidazol-2-yl)propyl)-2-(4-(2-(7-chloroquinolin-4-ylamino)ethyl)piperazin-1-yl)-2-oxoacetamide
    C23H28ClN7O2     相似度:60%
    Bioorganic & Medicinal Chemistry          2009          17          6451-6462
    Synthesis of oxalamide and triazine derivatives as a novel class of hybrid 4-aminoquinoline with potent antiplasmodial activity
    Naresh Sunduru, Moni Sharma, Kumkum Srivastava, S. Rajakumar, S.K. Puri, J.K. Saxena, Prem M.S. Chauhan
    Structure      13C NMR   碳谱模拟图

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    13 .     3-Iodo-4,4',5-trimethoxy-3'-O-tert-butyldiphenylsilyl-E-stilbene
    C33H35IO4Si     相似度:59.0%
    Journal of Natural Products          2012          75          385−393
    Antineoplastic Agents. 548. Synthesis of Iodo- and Diiodocombstatin Phosphate Prodrugs
    George R. Pettit, Heidi J. Rosenberg, Rachel Dixon, John C. Knight, Ernest Hamel,Jean-Charles Chapuis, Robin K. Pettit,Fiona Hogan, Brandy Sumner, Kenneth B. Ain,and Brindi Trickey-Platt
    Structure      13C NMR   碳谱模拟图

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    14 .     5-Methoxy-2-{N-[2-(2-hydroxy-5-iodo)benzamidoethyl]-N-n-propylamino}tetralin hydrochloride
    C23H29N2O3I     相似度:59.0%
    Bioorganic & Medicinal Chemistry          1998          6          2111-2126
    2-Aminotetralin-derived substituted benzamides with mixed dopamine D2, D3, and serotonin 5-HT1A receptor binding properties: A novel class of potential atypical antipsychotic agents
    Evert J. Homan, Swier Copinga, Lotta Elfström, Trees van der Veen, Jan-Pieter Hallema, Nina Mohell, Lena Unelius, Rolf Johansson, Håkan V. Wikström, Cor J. Grol
    Structure      13C NMR   碳谱模拟图

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    15 .     16-epi-isositsirikin
        相似度:57.1%
    Planta Medica          1982          46          88-90
    Alkaloide in Tabernaemontana-Arten, XVI [1] 1 2-Methoxy-17,18-dehydro-vincamine and 1 6-epi-Isositsirikine, Alkaloids from Tabernaemontana psorocarpa
    H. Achenbach, C. Renner und I. AddaeMensah
    Structure      13C NMR   碳谱模拟图

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    16 .     3-isorauniticine
        相似度:57.1%
    Planta Medica          1981          41          406-418
    13C NMR Data of 3-Isoajmalicine and 19-Epiajmalicine
    Raimo Uusvuori and Mauri Lounasmaa
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    17 .     compound 13
    C21H26N2O2     相似度:57.1%
    Phytochemistry          1999          51          839-844
    Alkaloids from the stem-bark of Alstonia macrophylla
    Toh-Seok Kam, Ing-Ho Iek, Yeun-Mun Choo
    Structure      13C NMR   碳谱模拟图

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    18 .     α-yohimbine
        相似度:57.1%
    Journal of Natural Products          1983          Vol 46          708-722
    Aspidosperma de Guyane: Alcaloïdes des Graines de Aspidosperma oblongum
    G. M. T. Robert, A. Ahond, C. Poupat, P. Potier, H. Jacquemin, S. K. Kan
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    19 .     (-)-tetrahydroalstonine
        相似度:57.1%
    Journal of Natural Products          1985          Vol 48          273-278
    Partial Synthesis via Indole Alkaloids: A New Hexacyclic Derivative of (-)-Tetrahydroalstonine
    Bernhard Mompon, Thierry Vassal, Philippe Poirier
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    20 .     (+)-vincadine
        相似度:57.1%
    Helvetica Chimica Acta          1976          59          2711-2723
    13C-NMR. Spectroscopy of Naturally Occuring Substances. XLII. Conformational analysis of quebrachamine-like indole alkaloids and related substances
    Ernest Wenkert, Edward W. Hagaman, Nicole Kunesch, Nai-yi Wang and Béla Zsadon
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    21 .     16β-carbomethoxy-15,20β-dihydrocleavamine
    C21H24O2N     相似度:57.1%
    Helvetica Chimica Acta          1976          59          2711-2723
    13C-NMR. Spectroscopy of Naturally Occuring Substances. XLII. Conformational analysis of quebrachamine-like indole alkaloids and related substances
    Ernest Wenkert, Edward W. Hagaman, Nicole Kunesch, Nai-yi Wang and Béla Zsadon
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    22 .     yohimbine
        相似度:57.1%
    Phytochemistry          1990          29          3377-3379
    17α-O-Methylyohimbine and vallesiachotamine from roots ofAmsonia elliptica
    Martina Sauerwein,Koichiro Shimomura
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    23 .     3-benzoyl-5-ethoxycarbonyl-1-phenyl-6-methyl-4-(3-nitro-phenyl)-3,4-dihydropyrimidin-2(1H)-one
    C27H23N3O6     相似度:57.1%
    Journal of Heterocyclic Chemistry          2001          38          1051-1054
    Investigation the chemical reactivity of positions N-3, C-5 and C6-methyl group in biginelli type compounds and synthesis of new dihydropyrimidine derivatives
    Y. R. Mirzaei, H. Azamat and H. Namazi
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    24 .     11-Hydroxypalmatine
    C21H22NO5I     相似度:57.1%
    Journal of Asian Natural products Research          2010          12          99-105
    Anti-hyperglycemic effect of 11-hydroxypalmatine, a palmatine derivative from Stephania glabra tubers
    Deepak Kumar Semwal; Usha Rawat; Ravindra Semwal; Randhir Singh; Gur Jas Preet Singh
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    25 .     5-(4-chlorophenyl)-N-(3-(4-(2,3-dichlorophenyl)piperazin-1-yl)propyl)-1,2-dimethyl-1H-pyrrole-3-carboxamide
        相似度:57.1%
    Bioorganic & Medicinal Chemistry          2010          18          6156-6169
    Further optimization of novel pyrrole 3-carboxamides for targeting serotonin 5-HT2A, 5-HT2C, and the serotonin transporter as a potential antidepressant
    Suk Youn Kang, Eun-Jung Park, Woo-Kyu Park, Hyun Jung Kim, Gildon Choi, Myung Eun Jung, Hee Jeong Seo, Min Ju Kim, Ae Nim Pae, Jeongmin Kim, Jinhwa Lee
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    26 .     tetrahydroalstonine
        相似度:57.1%
    Natural Product Research and Development          2007          19          235-239
    Indole Alkaloids from Rauwolfia vomitoria
    LI Lin;HE Hong-ping; ZHOU Hua; HAO Xiao-jiang
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    27 .     α-yohimbine
        相似度:57.1%
    Natural Product Research and Development          2007          19          235-239
    Indole Alkaloids from Rauwolfia vomitoria
    LI Lin;HE Hong-ping; ZHOU Hua; HAO Xiao-jiang
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    28 .     Segoline A
        相似度:56.5%
    Tetrahedron Letters          2001          42          2669-2671
    A new alkaloid from the purple Indian Ocean tunicate Eudistoma bituminis
    Isabelle Viracaoundin, Robert Faure, Emile Marcel Gaydou, Maurice Aknin
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    29 .     (4R,19S)-coleon A
        相似度:55%
    Phytochemistry          2006          67          1818-1825
    Insect-antifeedant and antibacterial activity of diterpenoids from species of Plectranthus
    Julia Wellsow, Renée J. Grayer, Nigel C. Veitch, Tetsuo Kokubun, Roberto Lelli, Geoffrey C. Kite, Monique S.J. Simmonds
    Structure      13C NMR   碳谱模拟图

    --------------------------------------------------------------------------------




    30 .     compound 2b
        相似度:55%
    Phytochemistry          2004          65          2101-2105
    Lignans from the roots of Echinops giganteus
    Mathieu Tene, Pierre Tane, Beiban L. Sondengam, Joseph D. Connolly
    Structure      13C NMR   碳谱模拟图,

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