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heroqe

木虫 (小有名气)

[求助] 求助微谱数据库查询

碳谱数据:12.4,16.2,33.9,35.8,39.0,39.2,45.9,58.5,59.6,64.2,105.5,110.4,117.2,118.3,120.7,125.6,126.7,133.5,136.6,140.8
溶剂是甲醇
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kaola0916

铁杆木虫 (著名写手)

【答案】应助回帖

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感谢参与,应助指数 +1
heroqe: 金币+20 2012-05-14 14:40:28
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
12.4,16.2,33.9,35.8,39.0,39.2,45.9,58.5,59.6,64.2,105.5,110.4,117.2,118.3,120.7,125.6,126.7,133.5,136.6,140.8
  
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125个化合物(查询结果仅供参考)  
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1 .     tetrahydro-akagerine
C20H28N2O2     相似度:70%
Phytochemistry          1987          26          2839-2846
Alkaloids of Strychnos johnsonii
Georges Massiot,Philippe Thépenier,Marie-José Jacquier,Louisette Le Men-Olivier,Robert Verpoorte,Clément Delaude
Structure      13C NMR   碳谱模拟图

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2 .     compound 3
    相似度:61.9%
Chemical & Pharmaceutical Bulletin          1980          28          2035-2038
Studies on Marine Natural Products. III. Two New Cembranolides from the Soft Coral Lobophytum pauciflorum (Ehrenberg)
YASUJI YAMADA,SUKEJI SUZUKI,KAZUO IGUCHI,HIROYUKI KIKUCHI,YASUMASA TSUKITANI and HARUO HORIAI
Structure      13C NMR   碳谱模拟图

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3 .     1-carboxytrypargine
C16H22N5O2     相似度:60%
Journal of Natural Products          1999          62          794-797
Trypargine Alkaloids from a Previously Undescribed Eudistoma sp. Ascidian
Ryan M. Van Wagoner, Jamaluddin Jompa, Akbar Tahir, and Chris M. Ireland
Structure      13C NMR   碳谱模拟图

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4 .     dehydrokoumidine
C19H20N2O     相似度:60%
Chemistry – An Asian Journal          2011          6          166-173
Seven New Monoterpenoid Indole Alkaloids from Gelsemium elegans
Yousuke Yamada, Mariko Kitajima, Noriyuki Kogure, Sumphan Wongseripipatana, and Hiromitsu Takayama
Structure      13C NMR   碳谱模拟图

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5 .     diangoutengjian I
    相似度:57.1%
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

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6 .     6-hydroxynidorellol
C20H34O3     相似度:55%
Phytochemistry          2008          69          2406-2410
Ent-3,4-seco-labdane and ent-labdane diterpenoids from Croton stipuliformis (Euphorbiaceae)
Freddy Ramos,Yoshihisa Takaishi,Yoshiki Kashiwada,Coralia Osorio,Carmenza Duque,Ricardo Acuña,Yoshinori Fujimoto
Structure      13C NMR   碳谱模拟图

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7 .     7(S)-geissoschizol oxindole
C19H24N2O2     相似度:55%
Phytochemistry          2009          70          1182-1186
Four tetracyclic oxindole alkaloids and a taberpsychine derivative from a Malayan Tabernaemontana
Kuan-Hon Lim, Kooi-Mow Sim, Guan-Huat Tan, Toh-Seok Kam
Structure      13C NMR   碳谱模拟图

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8 .     β-yohimbine
    相似度:55%
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

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9 .     corynantheol
    相似度:55%
Phytochemistry          1991          30          1697-1700
Matadine, a cytotoxic alkaloid from Strychnos gossweileri
J. Quetin-Leclercq, P. Coucke, C. Delaude, R. Warin, R. Bassleer, L. Angenot
Structure      13C NMR   碳谱模拟图

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10 .     19,20-dehydro-β-yohimbine
    相似度:55%
Phytochemistry          1991          30          3785-3792
Alkaloids from leaves and root bark ofErvatamia hirta
Pascale Clivio, Bernard Richard, Jean-Robert Deverre, Thierry Sevenet, Monique Zeches, Louisette Le Men-Oliver
Structure      13C NMR   碳谱模拟图

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11 .     corynantheol
    相似度:55%
Phytochemistry          1987          26          2839-2846
Alkaloids of Strychnos johnsonii
Georges Massiot,Philippe Thépenier,Marie-José Jacquier,Louisette Le Men-Olivier,Robert Verpoorte,Clément Delaude
Structure      13C NMR   碳谱模拟图

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12 .     corynantheol
    相似度:55%
Phytochemistry          1988          27          1923-1926
10-Hydroxy-Nb-methyl-corynantheol,a new quaternary alkaloid from the stem bark of Strychnos usambarensis
J. Quetin-Leclercq,L. Angenot
Structure      13C NMR   碳谱模拟图

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13 .     compound 19a
C18H16N4O2     相似度:55%
Journal of Heterocyclic Chemistry          2007          44          1373-1381
Stereochemistry of 1,3-dipolar-cycloaddition of 3,4-dihydroisoquinoline-and 3,4-dihydro-carboline-N-methoxycarbonyl-and N-phenacyl-methylides with maleic and fumaric nitrile
István Kádas,Gábor Szántó,László Tőke,AndrÁS Simon and Gábor Tóth
Structure      13C NMR   碳谱模拟图

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14 .     [2R-(2α,4aα,13β,14aβ)]-13b-allyl-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindolo[2',3':3,4]pyrido[1,2-b]isoquinolin-2-ol
C22H28N2O     相似度:55%
Journal of Heterocyclic Chemistry          2000          37          1081-1087
Addition reactions of allyl stannanes to an indolo[2',3':3,4]pyrido[1,2-b]isoquinoline imminium salt
Paul C. Unangst, Larry D. Bratton, David T. Connor, Bruce D. Roth, J. Ronald Rubin and Bharat K. Trivedi
Structure      13C NMR   碳谱模拟图

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15 .     (3R,12bS)-methyl (3-ethyl-3,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-ylidene)acetate
C20H24O2N2     相似度:55%
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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16 .     (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:55%
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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17 .     (S)-methyl 2-benzyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
C20H20N2O2     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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18 .     (R)-methyl 2-benzyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
C20H20N2O2     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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19 .     (R)-methyl 2-(cyclopropylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
C17H20N2O2     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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20 .     (S)-2-benzyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
C19H18N2O2     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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21 .     (R)-2-benzyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
C19H18N2O2     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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22 .     (S)-methyl 2-(4-hydroxybenzyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
C20H20N2O3     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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

23 .     (R)-methyl 2-(4-hydroxybenzyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
C20H20N2O3     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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

24 .     (S)-callophycin A
C19H18N2O3     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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

25 .     (R)-callophycin A
C19H18N2O3     相似度:55%
Bioorganic & Medicinal Chemistry          2011          19          6182-6195
Design, synthesis, and biological evaluation of callophycin A and analogues as potential chemopreventive and anticancer agents
Li Shen, Eun-Jung Park, Tamara P. Kondratyuk, Daniela Guendisch, Laura Marler, John M. Pezzuto, Anthony D. Wright, Dianqing Sun
Structure      13C NMR   碳谱模拟图

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26 .     callophycin A
C19H18N2O3     相似度:55%
Phytochemistry Letters          2011          4          69-71
Callophycin A, a cytotoxic tetrahydro-β-carboline from the red alga Callophycus oppositifolius
Simon P.B. Ovenden, Jonathan L. Nielson, Catherine H. Liptrot, Richard H. Willis, Dianne M. Tapiolas, Anthony D. Wright, Cherie A. Motti
Structure      13C NMR   碳谱模拟图

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27 .     compound 4h
    相似度:52.3%
Chemistry of Natural Compounds          2004          40          585-590
DIASTEREOTOPIC SYNTHESIS OF 1- AND 1,1-SUBSTITUTED 4-PHENYL-2,3,4,9-TETRAHYDRO-1H-b-CARBOLINES
B. B. Semenov, K. A. Novikov, A. N. Spitsin,V. N. Azev, and V. V. Kachala
Structure      13C NMR   碳谱模拟图

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28 .     dihydrositsirikine
    相似度:52.3%
Phytochemistry          1992          31          2507-2511
Indole alkaloids from Aspidosperma pruinosum
José J. Taveira, Domingos S. Nunes, Luzia Koike, Francisco de A.M. Reis
Structure      13C NMR   碳谱模拟图

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29 .     β-yohimbine
    相似度:52.3%
Phytochemistry          1991          30          1352-1353
3-epi-β-yohimbine from roots of Rauwolfia linearifolia
Jorge A.Martinez Pèrez, Carlos Gòmez González, María E.Sosa Rodríguez, Leticia T.Noda Llerena
Structure      13C NMR   碳谱模拟图

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30 .     (+)-6,7-dehydroepivincadine
    相似度:52.3%
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

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31 .     16α-carbomethoxy-15,20β-dihydrocleavamine
    相似度:52.3%
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

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32 .     16α-carbomethoxy-15,20α-dihydrocleavamine
    相似度:52.3%
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

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33 .     compound 16b
C23H18N4O     相似度:52.3%
Journal of Heterocyclic Chemistry          2007          44          1373-1381
Stereochemistry of 1,3-dipolar-cycloaddition of 3,4-dihydroisoquinoline-and 3,4-dihydro-carboline-N-methoxycarbonyl-and N-phenacyl-methylides with maleic and fumaric nitrile
István Kádas,Gábor Szántó,László Tőke,AndrÁS Simon and Gábor Tóth
Structure      13C NMR   碳谱模拟图

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34 .     methoxy-11-yohimbine
C22H28O4N2     相似度:52.3%
Phytochemistry          1977          16          803-805
Structure de deux methoxy-yohimbines, isolees de Rauwolfia capuroni
Christine Miet, Guy Croquelois, Jacques Poisson
Structure      13C NMR   碳谱模拟图

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35 .     yohimbine
    相似度:52.3%
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

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36 .     (E)-2-{3'-hydroxy-4'-methoxyphenyl}-1-phenyl-1-(3'',4'',5''-trimethoxyphenyl)-but-1-ene
C26H28O5     相似度:52.3%
Bioorganic & Medicinal Chemistry          2009          17          6993-7001
Application of the McMurry coupling reaction in the synthesis of tri- and tetra-arylethylene analogues as potential cancer chemotherapeutic agents
Rajendra P. Tanpure, Amanda R. Harkrider, Tracy E. Strecker, Ernest Hamel, Mary Lynn Trawick, Kevin G. Pinney
Structure      13C NMR   碳谱模拟图

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37 .     oridamycin B
C23H25NO4     相似度:52.1%
Journal of Natural Products          2010          73          698-701
Oridamycins A and B, Anti-Saprolegnia parasitica Indolosesquiterpenes Isolated from Streptomyces sp. KS84
Kentaro Takada, Hisatsugu Kajiwara and Nobutaka Imamura
Structure      13C NMR   碳谱模拟图

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38 .     14-Allyl-7-methyl-6,7,8,9,14,15-hexahydro-5H-indolo[3,2-f]-[3]benzazecine
C23H26N2     相似度:52.1%
Archiv der Pharmazie          2011          1          28-36
Residues at the Indole-NH of LE300 Modulate Affinities and Selectivities for Dopamine Receptors
Dina Robaa, Robert Kretschmer, Oliver Siol, Shams ElDin AbulAzm, ElSayeda ElKhawass,Jochen Lehmann, and Christoph Enzensperger
Structure      13C NMR   碳谱模拟图

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39 .     compound 22
    相似度:52.1%
Journal of Heterocyclic Chemistry          2000          37          245-251
Synthesis of vinca alkaloids and related compounds part 94. Epimerization of compounds with aspidospermane and D-secoaspidospermane skeleton
György Kalaus, Lajos Szabó, János Éles, Csaba Szántay, Imre Juhász, IstvÁn Greiner, János Brlik and Mária Kajtár-Peredy
Structure      13C NMR   碳谱模拟图

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40 .     lobophytolide A
C20H28O2     相似度:50%
Helvetica Chimica Acta          2008          Vol. 91          873
Six New Cembranolides from the Hainan Soft Coral Lobophytum sp.
Si-Han Chen, Yue-Wei Guo, Hui Huang, and Guido Cimino
Structure      13C NMR   碳谱模拟图

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41 .     5-hydroxyselaginellic acid
C18H24N2O3     相似度:50%
Journal of Natural Products          2009          72          1151-1154
Pyrrolidinoindoline Alkaloids from Selaginella moellendorfii
Yue-Hu Wang, Chun-Lin Long, Fu-Mei Yang, Xi Wang, Qian-Yun Sun, Hong-Sheng Wang, Ya-Na Shi, and Gui-Hua Tang
Structure      13C NMR   碳谱模拟图

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42 .     arisanschinin F
C22H28O6     相似度:50%
Journal of Natural Products          2009          72          1663-1668
Oxygenated Lignans from the Fruits of Schisandra arisanensis
Yuan-Bin Cheng, Meng-Ting Chang, Yi-Wen Lo, Ching-Jen Ho, Yuh-Chi Kuo, Ching-Te Chien, Shun-Ying Chen, Shorong-Shii Liou, Yao-Haur Kuo, and Ya-Ching Shen
Structure      13C NMR   碳谱模拟图

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43 .     12-hydroxygeranylgeraniol
    相似度:50%
Phytochemistry          2004          65          2063-2069
Trihydroxylated linear diterpenes from the brown alga Bifurcaria bifurcata
Gérald Culioli, Annick Ortalo-Magné, Mohammed Daoudi,Hélène Thomas-Guyon, Robert Valls, Louis Piovetti
Structure      13C NMR   碳谱模拟图

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44 .     2,7-dimethoxy-1,6-dimethyl-5-vinyl-phenathrene
C20H20O2     相似度:50%
Phytochemistry          2002          60          633-638
Phenanthrenoids from the wetland Juncus acutus
Marina DellaGreca, Antonio Fiorentino, Marina Isidori, Margherita Lavorgna,Pietro Monaco, Lucio Previtera, Armando Zarrelli
Structure      13C NMR   碳谱模拟图

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45 .     10β-hydroxy-2-epi-16-deoxysarcophine
C20H30O3     相似度:50%
Journal of Natural Products          2006          69          1010-1013
Biocatalytic and Antimetastatic Studies of the Marine Cembranoids Sarcophine and 2-epi-16-Deoxysarcophine
Swapnali S. Sawant, Diaa T. A. Youssef, Jane Reiland,Melissa Ferniz, Dario Marchetti, and Khalid A. El Sayed
Structure      13C NMR   碳谱模拟图

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46 .     rubrisandrin A 1b
C22H28O6     相似度:50%
Journal of Natural Products          2006          69          1697-1701
Rubrisandrins A and B, Lignans and Related Anti-HIV Compounds from Schisandra rubriflora
Min Chen, Nicole Kilgore, Kuo-Hsiung Lee, and Dao-Feng Chen
Structure      13C NMR   碳谱模拟图

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47 .     alstomicine
C20H26N2O2     相似度:50%
Journal of Natural Products          2004          67          547-552
New Indole Alkaloids from Alstonia macrophylla
Toh-Seok Kam, and Yeun-Mun Choo
Structure      13C NMR   碳谱模拟图

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48 .     oxoelaeocarpidine
C17H19N3O     相似度:50%
Journal of Natural Products          1997          60          791-793
Reductive Pictet-Spengler Cyclization of Nitriles in the Presence of Tryptamine: Synthesis of Indolo[2, 3-a]quinolizidine, Nazlinine, and Elaeocarpidine
Khalid Diker, Khalid El Biach, Michèle Döéde Maindreville, and Jean Lévy
Structure      13C NMR   碳谱模拟图

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

49 .     amerovolfin
    相似度:50%
Planta Medica          1989          55          283-285
Alkaloids from Rauwolfia cubana Stem Bark
Jorge. A. Martinez, Carlos Gomez, Tamara Santana, and Herman Velez
Structure      13C NMR   碳谱模拟图

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50 .     (±)-deplancheine
    相似度:50%
Planta Medica          1987          53          386-388
Elaboration of the Ethylidene Side Chain in the Synthesis of Indole Alkaloids: Preparation of (±)-Deplancheine and its Analogues
Reij a Jokela, Anne Juntunen, and Mauri Lounasmaa
Structure      13C NMR   碳谱模拟图

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

51 .     compound 5
    相似度:50%
Planta Medica          1987          53          386-388
Elaboration of the Ethylidene Side Chain in the Synthesis of Indole Alkaloids: Preparation of (±)-Deplancheine and its Analogues
Reij a Jokela, Anne Juntunen, and Mauri Lounasmaa
Structure      13C NMR   碳谱模拟图

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

52 .     evodiamine
    相似度:50%
Acta Botanica Yunnanica          2003          25(1)          103-106
A New Indoloquinazoline Alkaloid from the Fruit of Evodia rutaecarpa
ZUO Guo-Ying,HE Hong-Ping, WANGBin-Gui ,HONG Xin,HAO Xiao-Jiang
Structure      13C NMR   碳谱模拟图

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

53 .     met A-III
    相似度:50%
Chemical & Pharmaceutical Bulletin          1990          38          136-141
Studies on the Metabolism of Gomisin A (TJN-101). II. : Structure Determination of Biliary and Urinary Metabolites in Rat
Yukinobu IKEYA,Hiroshi MITSUHASHI,Hiromi SASAKI,Yutaka MATSUZAKI,Tamae MATSUZAKI and Eikichi HOSOYA
Structure      13C NMR   碳谱模拟图

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

54 .     met A-III
C22H26O7     相似度:50%
Chemical & Pharmaceutical Bulletin          1988          36          2061-2069
Studies on the Metabolism of Gomisin A (TJN-101). I. : Oxidative Products of Gomisin A Formed by Rat Liver S9 Mix.
YUKINOBU IKEYA,HEIHACHIRO TAGUCHI,HIROSHI MITSUHASHI,HIROMI SASAKI,TAMAE MATSUZAKI,MASAKI ABURADA and EIKICHI HOSOYA
Structure      13C NMR   碳谱模拟图

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

55 .     (-)-gomisin L2
C22H26O6     相似度:50%
Chemical & Pharmaceutical Bulletin          1982          30          132-139
The Constituents of Schizandra chinensis BAILL. X. The Structures of γ-Schizandrin and Four New Lignans, (-)-Gomisins L1 and L2, (±)-Gomisin M1 and (+)-Gomisin M2
YUKINOBU IKEYA,HEIHACHIRO TAGUCHI and ITIRO YOSIOKA
Structure      13C NMR   碳谱模拟图

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

56 .     compound 4a
    相似度:50%
Chemistry of Natural Compounds          2004          40          585-590
DIASTEREOTOPIC SYNTHESIS OF 1- AND 1,1-SUBSTITUTED 4-PHENYL-2,3,4,9-TETRAHYDRO-1H-b-CARBOLINES
B. B. Semenov, K. A. Novikov, A. N. Spitsin,V. N. Azev, and V. V. Kachala
Structure      13C NMR   碳谱模拟图

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

57 .     (+)-EVODIAMINE
C19H17N3O     相似度:50%
Chemistry of Natural Compounds          1997          33          221-267
QUINAZOLINE ALKALOIDS IN NATURE
A. L. D'yakonov and M. V. Telezhenetskaya
Structure      13C NMR   碳谱模拟图

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

58 .     herbadine
C21H24N2O4     相似度:50%
Chemistry of Natural Compounds          1996          32          216-334
ALKALOIDS. PLANTS, STRUCTURE, PROPERTIES
R. Shakirov, M. V. Telezhenetskaya, I. A. Bessonova,S. F. Aripova, I. A. Israilov, M. N. Sultankhodzhaev,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

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

59 .     bifurcadiol
    相似度:50%
Biochemical Systematics and Ecology          2008          36          484-489
Trihydroxylated linear diterpenes from the brown alga Bifurcaria bifurcata (Fucales, Phaeophyta)
Mohamed El Hattab, Mohammed Ben Mesaoud, Mohammed Daoudi, Annick Ortalo-Magné, Gérald Culioli, Robert Valls, Louis Piovetti
Structure      13C NMR   碳谱模拟图

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

60 .     vomicine
    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

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

61 .     PJ157
C22H28N2O3     相似度:50%
Journal of Asian Natural Products Research          2007          9          197-201
Two diketopiperazines from marine fungus Gliocladium sp.YUP08
Y.-F. HUANG, L. TIAN, H.-M. HUA and Y.-H. PEI
Structure      13C NMR   碳谱模拟图

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

62 .     N1-rnethylvoaphylline
C20H26N2O     相似度:50%
Natural Product Research          1995          7          191-195
Voafinine and N1-Methylvoafinine, Novel Aspidosperma Alkaloids from Tabernaemontana
Toh-Seok Kam; S. Anuradha
Structure      13C NMR   碳谱模拟图

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

63 .     voalenine
C19H22N2O3     相似度:50%
Natural Product Research          1996          8          49-53
Voafinidine and Voalenine, Novel Indoles of the Aspidosperma-type from Tabernaemontana
Toh-Seok Kam; S. Anuradha; Kah-Yeng Loh
Structure      13C NMR   碳谱模拟图

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

64 .     isothalisopavine
C20H23NO4     相似度:50%
Phytochemistry          1998          48          403-405
An isopavine alkaloid from Thalictrum minus
Atanas K. Sidjimov, Jeanne N. Tawara, Frank R. Stermitz, Christopher D. Rithner
Structure      13C NMR   碳谱模拟图

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

65 .     melodinine F
C20H26N2O2     相似度:50%
Journal of Natural Products          2010          73          22-26
Melodinines A−G, Monoterpenoid Indole Alkaloids from Melodinus henryi
Tao Feng, Xiang-Hai Cai, Ya-Ping Liu, Yan Li, Yuan-Yuan Wang and Xiao-Dong Luo
Structure      13C NMR   碳谱模拟图

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

66 .     melodinine G
C19H22N2O     相似度:50%
Journal of Natural Products          2010          73          22-26
Melodinines A−G, Monoterpenoid Indole Alkaloids from Melodinus henryi
Tao Feng, Xiang-Hai Cai, Ya-Ping Liu, Yan Li, Yuan-Yuan Wang and Xiao-Dong Luo
Structure      13C NMR   碳谱模拟图

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

67 .     10-hydroxydepressin
C20H30O2     相似度:50%
Journal of Natural Products          2010          73          133-138
Rare Casbane Diterpenoids from the Hainan Soft Coral Sinularia depressa
Yan Li, Marianna Carbone, Rosa Maria Vitale, Pietro Amodeo, Francesco Castelluccio, Giovanna Sicilia, Ernesto Mollo, Michela Nappo, Guido Cimino, Yue-Wei Guo and Margherita Gavagnin
Structure      13C NMR   碳谱模拟图

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

68 .     △-14 vincanol
    相似度:50%
Journal of Natural Products          1991          Vol 54          372
Methylene-10,10'bis[(+)Na-norvallesamidine], Dichlorure de Methylene Nb,Nb'[Bis(+)meloninium], Chlorures de Nb'-Chloromethyl Celastromelinium et Celastromelidinium: Alcaloïdes Dimeres, Artefacts Possibles d'Extraction de Melodinus celastroides
H. Mehri, S. Baassou, M. Plat
Structure      13C NMR   碳谱模拟图

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

69 .     oceanapamine
C20H33N3     相似度:50%
Journal of Natural Products          1995          Vol 58          302
Oceanapamine, a Sesquiterpene Alkaloid from the Philippine Sponge Oceanapia sp.
Kenneth G. Boyd, Mary Kay Harper, D. John Faulkner
Structure      13C NMR   碳谱模拟图

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

70 .     16-epi-Silicine
    相似度:50%
Phytochemistry          1995          40          987-990
16-epi-silicine, an alkaloid of the ervatamine-type from Pandaca caducifolia
Pascale Clivio, Bernard Richard, Jean-Marc Nuzillard, Monique Zèches-Hanrot
Structure      13C NMR   碳谱模拟图

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

71 .     Neolaugerine
C19H24N2O2     相似度:50%
Phytochemistry          1993          32          1587-1590
Oxindole alkaloids from Neolaugeria resinosa
Bernard Weniger, Yulin Jiang, Robert Anton, Jaume Bastida, Teresa Varea, Jean-Charles Quirion
Structure      13C NMR   碳谱模拟图

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

72 .     normacusine B
    相似度:50%
Phytochemistry          1991          30          3785-3792
Alkaloids from leaves and root bark ofErvatamia hirta
Pascale Clivio, Bernard Richard, Jean-Robert Deverre, Thierry Sevenet, Monique Zeches, Louisette Le Men-Oliver
Structure      13C NMR   碳谱模拟图

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

73 .     1-{1-methyl-2-[2-phenylmethyl)phenoxy]ethyl}-4-piperidinol
    相似度:50%
Chemical Research in Chinese Universities          2006          22          455-456
Glucuronidation of Two NovelMetabolites of Benproperine with Trichloroacetimidate Donor
LIYan, HARA Osamu, MAEBA Isamu and ZHONG Da-fang
Structure      13C NMR   碳谱模拟图

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

74 .     ajmalicine
    相似度:50%
Helvetica Chimica Acta          1976          59          2254-2260
13C-NMR. Analysis of the Roxburghines
Lucio Merlini, Rosanna Mondelli, Gianluca Nasini, Felix W. Wehrli, Edward W. Hagaman and Ernest Wenkert
Structure      13C NMR   碳谱模拟图

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

75 .     8,11,13,15-Cleistanthatetraene-3,12-diol
C20H28O2     相似度:50%
Zeitschrift für Naturforschung B          2004          59b          58-62
Chemical Composition and Antitumor Activities from Givotia madagascariensis
Hans C. Krebs, Helmut Duddeck, Shahid Malik, Winfried Beil, Philippe Rasoanaivo, and Mamy Andrianarijaona
Structure      13C NMR   碳谱模拟图

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

76 .     (3aS,8aR)-3a-Ethyl-1,2,3,3a,8,8a-hexahydro-1,8-dimethyl-5-(1H-1,2,3-triazol-1-yl)pyrrolo[2,3-b]indole
C16H21N5     相似度:50%
Helvetica Chimica Acta          2011          Vol. 94          1496-1505
An Efficient Synthesis of a (-)-Physostigmine s Library for Identifying Potential Anti-Alzheimer s Agents
Yi Wu, Fusheng Wang, Hao Song, and Yong Qin
Structure      13C NMR   碳谱模拟图

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

77 .     (3aS,8aR)-3a-Ethyl-1,2,3,3a,8,8a-hexahydro-1,8-dimethyl-5-(4-phenyl-1H-1,2,3-triazol-1-yl)pyrrolo[2,3-b]indole
C22H25N5     相似度:50%
Helvetica Chimica Acta          2011          Vol. 94          1496-1505
An Efficient Synthesis of a (-)-Physostigmine s Library for Identifying Potential Anti-Alzheimer s Agents
Yi Wu, Fusheng Wang, Hao Song, and Yong Qin
Structure      13C NMR   碳谱模拟图

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

78 .     Ethyl 1-[(3aS,8aR)-3a-Ethyl-1,2,3,3a,8,8a-hexahydro-1,8-dimethylpyrrolo[2,3-b]indol-5-yl]-1H-1,2,3-triazole-4-carboxylat
C19H25N5O2     相似度:50%
Helvetica Chimica Acta          2011          Vol. 94          1496-1505
An Efficient Synthesis of a (-)-Physostigmine s Library for Identifying Potential Anti-Alzheimer s Agents
Yi Wu, Fusheng Wang, Hao Song, and Yong Qin
Structure      13C NMR   碳谱模拟图

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

79 .     14-Ethyl-7-methyl-6,7,8,9,14,15-hexahydro-5H-indolo-[3,2-f][3]benzazecine
C22H26N2     相似度:50%
Archiv der Pharmazie          2011          1          28-36
Residues at the Indole-NH of LE300 Modulate Affinities and Selectivities for Dopamine Receptors
Dina Robaa, Robert Kretschmer, Oliver Siol, Shams ElDin AbulAzm, ElSayeda ElKhawass,Jochen Lehmann, and Christoph Enzensperger
Structure      13C NMR   碳谱模拟图

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

80 .     Chartellamide B
    相似度:50%
Marine drugs          2010          8          1526-1549
Halogenated Indole Alkaloids from Marine Invertebrates
Patrícia Mendonça Pauletti,Lucas Silva Cintra,Caio Guedes Braguine,Ademar Alves da Silva Filho,Márcio Luís Andrade e Silva,Wilson Roberto Cunha and Ana Helena Januário
Structure      13C NMR   碳谱模拟图

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

81 .     (+)-11,12-epoxysarcophytol A
    相似度:50%
Tetrahedron Letters          2000          41          2181-2184
First total synthesis and absolute configuration of marine cembrane diterpenoid (+)-11,12-epoxysarcophytol A
Jiong Lan, Zuosheng Liu, Hao Yuan, Lizeng Peng, Wei-Dong Z. Li, Ying Li, Yulin Li, Albert S. C. Chan
Structure      13C NMR   碳谱模拟图

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

82 .     compound E-2
    相似度:50%
Tetrahedron Letters          2000          41          5057-5061
Enhancement of the π-electron delocalization and fluorescence efficiency of 1,6-diphenyl-1,3,5-hexatriene by covalent rigidification
Bruno Jousselme, Philippe Blanchard, Pierre Frère, Jean Roncali
Structure      13C NMR   碳谱模拟图

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

83 .     compound Z-2
    相似度:50%
Tetrahedron Letters          2000          41          5057-5061
Enhancement of the π-electron delocalization and fluorescence efficiency of 1,6-diphenyl-1,3,5-hexatriene by covalent rigidification
Bruno Jousselme, Philippe Blanchard, Pierre Frère, Jean Roncali
Structure      13C NMR   碳谱模拟图

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

84 .     compound 7(9E,11E)
    相似度:50%
Tetrahedron Letters          2000          41          7221-7224
Syntheses of new 9- and 13-methylene isomers of retinal
Alain Laurent, Virginie Prat, Alain Valla, Zo Andriamialisoa, Michel Giraud, Roger Labia, Pierre Potier
Structure      13C NMR   碳谱模拟图

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

85 .     koumidine
    相似度:50%
Phytochemistry          1987          26          2875-2876
Revision of the stereochemistry of koumidine
Yeh Schun,Geoffrey A. Cordell
Structure      13C NMR   碳谱模拟图

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

86 .     N(α)-demethylaccedine
C19H22O2N2     相似度:50%
Phytochemistry          1989          28          961-962
An alkaloid from two Rauwolfia spp.
Jorge A. Martìnez,Hermàn Velez,Tamara Santana
Structure      13C NMR   碳谱模拟图

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

87 .     methyl 1,2,3,4-tetrahydro-1-phenyl-9H-pyrido [3,4-b]indole-3-carboxylate
C19H18N2O2     相似度:50%
Journal of Heterocyclic Chemistry          2006          43          767-772
Pictet-spengler cyclization in room temperature ionic liquid: A convenient access to tetrahydro β-carbolines
M. Muthukrishnan,Shivaji V. More,Dinesh R. Garud,C. V. Ramana,R. R. Joshi and R. A. Joshi
Structure      13C NMR   碳谱模拟图

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

88 .     lobophytolide A
    相似度:50%
China Journal of Chinese Materia Medica          2010          35          177-179
Cembranoid diterpenes from soft coral Sinularia sp.
LV Fang; WANG Xianjie; DAI Rongji; DENG Yulin
Structure      13C NMR   碳谱模拟图

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

89 .     4-(4-isopropylphenyl)-10-methylthiopyrano[3,2-b][1,4]benzoxazine-2,3-dicarboxylic acid dimethyl ester
C25H25NO5S     相似度:50%
Heterocycles          2005          65          579-589
Synthesis of 2-Substituted Thiopyrano[3,2-b][1,4]benzoxazine-2,3-dicarboxylic Acid Dimethyl Esters
Sukanta Kamila, Hongming Zhang, Dumming Zhu, and Edward R. Biehl*
Structure      13C NMR   碳谱模拟图

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

90 .     2,5-bis (3-n-butyl-5-formyl-4-methyl-2-pyrrolylmethyl)-3,4-diethyl-1H-pyrrole
C44H55N3O4     相似度:50%
Heterocycles          2004          62          365-373
A New Synthesis of Mono- and Dibenzosapphyrins
Noboru Ono,* Kenji Kuroki, Eriko Watanabe, Naoyuki Ochi, and Hidemitsu Uno
Structure      13C NMR   碳谱模拟图

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

91 .     (E)-caracasanamide
C21H32N4O3,     相似度:50%
Bioorganic & Medicinal Chemistry Letters          1992          2          415-418
Caracasanamide, a novel hypotensive agent from Verbesina caracasana
Giuliano Delle Monache, Bruno Botta, Franco Delle Monache, Romulo Espinal, Stella C. De Bonnevaux, Carlo De Luca, Maurizio Botta, Federico Corelli, Marco Carmignani
Structure      13C NMR   碳谱模拟图

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

92 .     Compound 2
    相似度:50%
Bioorganic & Medicinal Chemistry Letters          1994          4          2705-2708
Synthesis and enzymatic hydrolysis of a light-emitting substrate for phosphotriesterase
Suk-bong Hong, Frank M. Raushel
Structure      13C NMR   碳谱模拟图

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

93 .     dihydrocembrene C
C20H32O     相似度:50%
Chemistry & Biodiversity          2010          7          2007-2015
Terpenes from the Soft Corals Litophyton arboreum and Sarcophyton ehrenbergi
Kamel H. Shaker, Michael Müller, M. Abdel Ghani, Hans-Martin Dahse and Karlheinz Seifert
Structure      13C NMR   碳谱模拟图

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

94 .     normacusine B
C19H22N2O     相似度:50%
Phytochemical Analysis          1997          8          115-119
Tertiary Alkaloid Fraction of Strychnos atlantica: Confirmation of the Identity and Structures of Indole Alkaloids by High Field Nuclear Magnetic Resonance Spectroscopy
Rabindranath Mukherjee, Tania M. S. da Silva, João B. L. Guimarães, Eduardo de J. Oliveira, Paul A. Keifer and James N. Shoolery
Structure      13C NMR   碳谱模拟图

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

95 .     compound 1
C20H24O2     相似度:50%
Phytochemistry          1986          25          751-752
An acyclic diterpene from the brown alga Bifurcaria bifurcata
Robert Valls, Bernard Banaigs, Christian Francisco, Louis Codomier, Adrien Cave
Structure      13C NMR   碳谱模拟图

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

96 .     amsonic acid
C20H24N2O4     相似度:50%
Chinese Traditional and Herbal Drugs          2003          34          390-392
Studies on chemical constituents of Amsonia sinensis
WANG Ai-guo; FENG Xiao-zhang
Structure      13C NMR   碳谱模拟图

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

97 .     Gliocladride B
    相似度:50%
Pharmazie          2009          64          616-618
Cytotoxic piperazine-2,5-dione derivatives from marine fungus Gliocladium sp.
Yao Yao, Li Tian, Juan Li, Jiaqing Cao and Yuehu Pei
Structure      13C NMR   碳谱模拟图

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

98 .     Vomicine
C22H24O4N2     相似度:50%
Chemistry of Natural Compounds          2010          46          154-157
Alkaloids of Eminium lehmannii
G. T. Zharylgasina, L. A. Musina, I. Yu. Bagryanskaya, M. M. Shakirov and B. I. Tuleuov, et al.
Structure      13C NMR   碳谱模拟图

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

99 .     3-hydroxy-4-[5-(trifluoromethyl)isoxazol-3-yl]-phenyl moiety
C20H22F3NO5     相似度:50%
Tetrahedron Letters          2002          43          8955-8958
Synthesis of bicyclic dioxetanes bearing a 3-hydroxy-4-isoxazolylphenyl moiety: new CIEEL-active dioxetanes emitting light with remarkable high-efficiency in aqueous medium
Masakatsu Matsumoto, Toshimitsu Sakuma, Nobuko Watanabe
Structure      13C NMR   碳谱模拟图

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

100 .     compound 1
C19H22N2O     相似度:50%
Tetrahedron Letters          2003          44          8013-8017
The first enantiospecific synthesis of (−-koumidine via the intramolecular palladium-catalyzed enolate driven cross coupling reaction. The stereospecific introduction of the 19-(Z) ethylidene side chain
Hui Cao, Jianming Yu, Xiangyu Z. Wearing, Chunchun Zhang, Xiaoxiang Liu, Jeffery Deschamps, James M. Cook
Structure      13C NMR   碳谱模拟图
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