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zgykdxjsbd

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25.8,34.4,42.0,53.6,60.5,116.3,122.0,127.1,127.9,128.5,128.7,128.9,129.2,132.5,134.6,145.5,151.8
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糊涂虫

优秀版主

【答案】应助回帖

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感谢参与,应助指数 +1
zgykdxjsbd: 金币+8 2014-03-07 22:48:54
查询结果:共查到3068个化合物(查询结果仅供参考)
1 .     Asimilobine
    相似度:100%
Fitoterapia          2011          82          637-641
A novel aporphine alkaloid from Magnolia officinalis
Zuo-Fu Guo, Xiao-Bing Wang, Jian-Guang Luo, Jun Luo, Jun-Song Wang, Ling-Yi Kong
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
2 .     nornuciferine
    相似度:72.2%
Biochemical Systematics and Ecology          2012          41          115-118
Chemical constituents from the leaves of Annona pickelii (Annonaceae)
Livia Macedo Dutra, Emmanoel Vilaça Costa, Valéria Regina de Souza Moraes, Paulo Cesar de Lima Nogueira, Mayara Evelyn Vendramin, Andersson Barison, Ana Paula do Nascimento Prata
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
3 .     4-(4-bromophenyl)-2,3-dihydro-2-styryl-1,5-benzothiazepine
C23H18BrNS     相似度:70.5%
Journal of Heterocyclic Chemistry          2004          41          399-403
A new regioselective synthesis and bioactivity of 1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one derivatives
Hong-Qing Wang,Zhao-Jie Liu,Li-Min Yang and Ming-Wu Ding
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
4 .     (-)-(R)-11-methoxy-10-methylnoraporphine
C18H19NO     相似度:70.5%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
5 .     (-)-(R)-11-hydroxy-10-methylnoraporphine
C17H17NO     相似度:70.5%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
6 .     Anonaine
    相似度:70.5%
Fitoterapia          2011          82          637-641
A novel aporphine alkaloid from Magnolia officinalis
Zuo-Fu Guo, Xiao-Bing Wang, Jian-Guang Luo, Jun Luo, Jun-Song Wang, Ling-Yi Kong
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
7 .     N-methylasimilobine
C18H19NO2     相似度:66.6%
Journal of Natural Products          2000          63          477-479
Aporphine Glycosides from Stephania cepharantha Seeds
Noriaki Kashiwaba, Minoru Ono, Jun Toda, Hideki Suzuki, and Takehiro Sano
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
8 .     2,3-dihydro-1,3-dioxo-2,7-diphenyl-4-(1-pyrrolidinyl)-1H-isoindole-5-carbonitrile
C25H19N3O2     相似度:66.6%
Heterocycles          2009          77          617-628
Diels-Alder Reaction of 2-(Cyclic Amino)-substituted 3-Furancarbonitriles with Maleimides to Phthalimides
Hiroshi Maruoka, Fumi Okabe, Yoshimichi Koutake, Toshihiro Fujioka, and Kenji Yamagata
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
9 .     4-[2-(1,3-dioxo-1H-benzo[de]isoquinoline-2(3H)-yl)benzyl]-N'-[(1E)-phenylmethylene]benzenesulphonylhydrazone
C27H21N3O4S     相似度:66.6%
Bioorganic & Medicinal Chemistry          2011          19          6285-6291
Evaluation of apoptotic effect of cyclic imide derivatives on murine B16F10 melanoma cells
Karina Elisa Machado, Kely Navakoski de Oliveira, Lorena Santos-Bubniak, Marley Aparecida Licínio, Ricardo José Nunes, Maria Cláudia Santos-Silva
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
10 .     [(6-bromo-2-methoxyquinolin-3-yl)-phenyl-methyl]-pyridin-4-ylmethyl-amine
    相似度:66.6%
Bioorganic & Medicinal Chemistry          2009          17          2830-2841
Design, synthesis, biological evaluation and molecular modelling studies of novel quinoline derivatives against Mycobacterium tuberculosis
Ram Shankar Upadhayaya, Jaya Kishore Vandavasi, Nageswara Rao Vasireddy, Vivek Sharma, Shailesh S. Dixit, Jyoti Chattopadhyaya
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
11 .     2,4,6,6-tetraphenyl-2,3-diaza-1-phosphabicyclo[3.1.0]hex-3-ene
    相似度:66.6%
European Journal of Organic Chemistry          2010                   2504-2511
Phosphiranes as Ligands: Tungsten(0) and Palladium(0) Complexes of Phosphirano[1,2-c][1,2,3]diazaphospholes
Stefan Maurer, Christian Burkhart and Gerhard Maas
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
12 .     (-)-(R)-11-methoxy-10-vinylaporphine
C20H21NO     相似度:65%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
13 .     N'-(4-(benzyl(methyl)amino)-3-cyano-5-phenylthiophen-2-yl)-N,N-dimethylformimidamide
C22H22N4S     相似度:65%
Bioorganic & Medicinal Chemistry          2013          21          2229-2240
Discovery of thienopyrimidine-based inhibitors of the human farnesyl pyrophosphate synthase—Parallel synthesis of analogs via a trimethylsilyl ylidene intermediate
Chun-Yuen Leung, Adrienne M. Langille, John Mancuso, Youla S. Tsantrizos
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
14 .     p-coumaroyl-β-phenethylamine
C17H17NO2     相似度:64.7%
Phytochemistry          1999          50          1069-1072
Phenolic compounds from Anomianthus dulcis
Andrea Sinz, Rudolf Matusch, Floris van Elsacker, Thawatchai Santisuk, Suttiporn Chaichanα, Vichai Reutrakul
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
15 .     3-O-methylviridicatin
    相似度:64.7%
Journal of Natural Products          1988          Vol 51          66
Verrucofortine, a Major Metabolite of Penicillium verrucosum var. Cyclopium, the Fungus That Produces the Mycotoxin Verrucosidin
Richard P. Hodge, Constance M. Harris, Thomas M. Harris
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
16 .     opuntin B
C17H13NO3     相似度:64.7%
Acta Pharmaceutica Sinica          2003          Vol 38          677-679
A new alkaloid from opuntia vulgaris
JIANG Jian qin; YE Wen cai; LIU Yu hong; CHEN Zhen; MIN Zhi da; LOU Feng chang
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
17 .     2-phenylethyl caffeoate
C17H16O4     相似度:64.7%
Phytochemistry          1991          30          2089-2091
Caffeic acid esters and triterpenes of Alibertia macrophylla
Vanderlan da S. Bolzani, Lígia M.V. Trevisan, M.Claudia M. Young
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
18 .     Scholarisine I
C17H13NO2     相似度:64.7%
Zeitschrift für Naturforschung B          2010          65b          1164-1168
Novel Alkaloids from Alstonia scholaris
Xiang-Hai Cai, Jian-Hua Shang, Tao Feng, and Xiao-Dong Luo
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
19 .     5,7-diacetyl-2,6-diphemyl-2H-pyrrolo[2,1-c][1,2,4]triazole
C21H17N3O2     相似度:64.7%
Journal of Heterocyclic Chemistry          2007          44          393-401
A new series of non-classical type C heteropentalenes: 2H-pyrrolo[2,1-c][1,2,4]triazoles
Dietrich Moderhack and Jan-Christoph Schneider
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
20 .     4-(4-chlorophenyl)-2,3-dihydro-2-styryl-1,5-benzothiazepine
C23H18ClNS     相似度:64.7%
Journal of Heterocyclic Chemistry          2004          41          399-403
A new regioselective synthesis and bioactivity of 1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one derivatives
Hong-Qing Wang,Zhao-Jie Liu,Li-Min Yang and Ming-Wu Ding
追求卓越,敢为先锋
2楼2014-03-07 11:11:23
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

zxw_ll

木虫 (著名写手)

【答案】应助回帖

感谢参与,应助指数 +1
查询结果:共查到3068个化合物(查询结果仅供参考)  
--------------------------------------------------------------------------------

1 .     Asimilobine
    相似度:100%
Fitoterapia          2011          82          637-641
A novel aporphine alkaloid from Magnolia officinalis
Zuo-Fu Guo, Xiao-Bing Wang, Jian-Guang Luo, Jun Luo, Jun-Song Wang, Ling-Yi Kong
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     nornuciferine
    相似度:72.2%
Biochemical Systematics and Ecology          2012          41          115-118
Chemical constituents from the leaves of Annona pickelii (Annonaceae)
Livia Macedo Dutra, Emmanoel Vilaça Costa, Valéria Regina de Souza Moraes, Paulo Cesar de Lima Nogueira, Mayara Evelyn Vendramin, Andersson Barison, Ana Paula do Nascimento Prata
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     4-(4-bromophenyl)-2,3-dihydro-2-styryl-1,5-benzothiazepine
C23H18BrNS     相似度:70.5%
Journal of Heterocyclic Chemistry          2004          41          399-403
A new regioselective synthesis and bioactivity of 1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one derivatives
Hong-Qing Wang,Zhao-Jie Liu,Li-Min Yang and Ming-Wu Ding
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     (-)-(R)-11-methoxy-10-methylnoraporphine
C18H19NO     相似度:70.5%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     (-)-(R)-11-hydroxy-10-methylnoraporphine
C17H17NO     相似度:70.5%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     Anonaine
    相似度:70.5%
Fitoterapia          2011          82          637-641
A novel aporphine alkaloid from Magnolia officinalis
Zuo-Fu Guo, Xiao-Bing Wang, Jian-Guang Luo, Jun Luo, Jun-Song Wang, Ling-Yi Kong
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     N-methylasimilobine
C18H19NO2     相似度:66.6%
Journal of Natural Products          2000          63          477-479
Aporphine Glycosides from Stephania cepharantha Seeds
Noriaki Kashiwaba, Minoru Ono, Jun Toda, Hideki Suzuki, and Takehiro Sano
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     2,3-dihydro-1,3-dioxo-2,7-diphenyl-4-(1-pyrrolidinyl)-1H-isoindole-5-carbonitrile
C25H19N3O2     相似度:66.6%
Heterocycles          2009          77          617-628
Diels-Alder Reaction of 2-(Cyclic Amino)-substituted 3-Furancarbonitriles with Maleimides to Phthalimides
Hiroshi Maruoka, Fumi Okabe, Yoshimichi Koutake, Toshihiro Fujioka, and Kenji Yamagata
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     4-[2-(1,3-dioxo-1H-benzo[de]isoquinoline-2(3H)-yl)benzyl]-N'-[(1E)-phenylmethylene]benzenesulphonylhydrazone
C27H21N3O4S     相似度:66.6%
Bioorganic & Medicinal Chemistry          2011          19          6285-6291
Evaluation of apoptotic effect of cyclic imide derivatives on murine B16F10 melanoma cells
Karina Elisa Machado, Kely Navakoski de Oliveira, Lorena Santos-Bubniak, Marley Aparecida Licínio, Ricardo José Nunes, Maria Cláudia Santos-Silva
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     [(6-bromo-2-methoxyquinolin-3-yl)-phenyl-methyl]-pyridin-4-ylmethyl-amine
    相似度:66.6%
Bioorganic & Medicinal Chemistry          2009          17          2830-2841
Design, synthesis, biological evaluation and molecular modelling studies of novel quinoline derivatives against Mycobacterium tuberculosis
Ram Shankar Upadhayaya, Jaya Kishore Vandavasi, Nageswara Rao Vasireddy, Vivek Sharma, Shailesh S. Dixit, Jyoti Chattopadhyaya
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     2,4,6,6-tetraphenyl-2,3-diaza-1-phosphabicyclo[3.1.0]hex-3-ene
    相似度:66.6%
European Journal of Organic Chemistry          2010                   2504-2511
Phosphiranes as Ligands: Tungsten(0) and Palladium(0) Complexes of Phosphirano[1,2-c][1,2,3]diazaphospholes
Stefan Maurer, Christian Burkhart and Gerhard Maas
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     (-)-(R)-11-methoxy-10-vinylaporphine
C20H21NO     相似度:65%
Journal of Medicinal Chemistry          1996          39          3491-3502
10-Substituted 11-Oxygenated (R)-Aporphines:  Synthesis, Pharmacology, and Modeling of 5-HT1A Receptor Interactions
Martin H. Hedberg, Johanna M. Jansen, Gunnar Nordvall, Stephan Hjorth, Lena Unelius, and Anette M. Johansson
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     N'-(4-(benzyl(methyl)amino)-3-cyano-5-phenylthiophen-2-yl)-N,N-dimethylformimidamide
C22H22N4S     相似度:65%
Bioorganic & Medicinal Chemistry          2013          21          2229-2240
Discovery of thienopyrimidine-based inhibitors of the human farnesyl pyrophosphate synthase—Parallel synthesis of analogs via a trimethylsilyl ylidene intermediate
Chun-Yuen Leung, Adrienne M. Langille, John Mancuso, Youla S. Tsantrizos
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     p-coumaroyl-β-phenethylamine
C17H17NO2     相似度:64.7%
Phytochemistry          1999          50          1069-1072
Phenolic compounds from Anomianthus dulcis
Andrea Sinz, Rudolf Matusch, Floris van Elsacker, Thawatchai Santisuk, Suttiporn Chaichanα, Vichai Reutrakul
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     3-O-methylviridicatin
    相似度:64.7%
Journal of Natural Products          1988          Vol 51          66
Verrucofortine, a Major Metabolite of Penicillium verrucosum var. Cyclopium, the Fungus That Produces the Mycotoxin Verrucosidin
Richard P. Hodge, Constance M. Harris, Thomas M. Harris
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     opuntin B
C17H13NO3     相似度:64.7%
Acta Pharmaceutica Sinica          2003          Vol 38          677-679
A new alkaloid from opuntia vulgaris
JIANG Jian qin; YE Wen cai; LIU Yu hong; CHEN Zhen; MIN Zhi da; LOU Feng chang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

17 .     2-phenylethyl caffeoate
C17H16O4     相似度:64.7%
Phytochemistry          1991          30          2089-2091
Caffeic acid esters and triterpenes of Alibertia macrophylla
Vanderlan da S. Bolzani, Lígia M.V. Trevisan, M.Claudia M. Young
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

18 .     Scholarisine I
C17H13NO2     相似度:64.7%
Zeitschrift für Naturforschung B          2010          65b          1164-1168
Novel Alkaloids from Alstonia scholaris
Xiang-Hai Cai, Jian-Hua Shang, Tao Feng, and Xiao-Dong Luo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     5,7-diacetyl-2,6-diphemyl-2H-pyrrolo[2,1-c][1,2,4]triazole
C21H17N3O2     相似度:64.7%
Journal of Heterocyclic Chemistry          2007          44          393-401
A new series of non-classical type C heteropentalenes: 2H-pyrrolo[2,1-c][1,2,4]triazoles
Dietrich Moderhack and Jan-Christoph Schneider
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     4-(4-chlorophenyl)-2,3-dihydro-2-styryl-1,5-benzothiazepine
C23H18ClNS     相似度:64.7%
Journal of Heterocyclic Chemistry          2004          41          399-403
A new regioselective synthesis and bioactivity of 1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one derivatives
Hong-Qing Wang,Zhao-Jie Liu,Li-Min Yang and Ming-Wu Ding
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

21 .     7-methyl-7H-quinazolino[3,2-a][4,1]genzoxazepine-5,13-dione
C17H12N2O3     相似度:64.7%
Journal of Heterocyclic Chemistry          2002          39          351-355
Oxygen analogues of the benzodiazepine alkaloids sclerotigenin and circumdatin F
F. Anette Witt and Jan Bergman
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

22 .     3-oxo-2-phenyl-3-(3,4,5-trimethoxyphenyl)propanoic acid,2-phenylhydrazide
C24H24N2O5     相似度:64.7%
Journal of Heterocyclic Chemistry          2001          38          695-701
Preparation of substituted 1,2-Dihydro-3H-pyrazol-3-ones from polylithiated 2'-phenylphenylacetohydrazides and aromatic esters
Jennifer R. Downs, Stefan J. Pastine, Jessica D. Townsend, Heather A. Greer, Wayne Kelley Jr., Deborah A. Schady, Teresa Lentz Mcconaughy, Clyde R. Metz, Charles F. Beam, Catharine D. Almquist, William T. Pennington and Rosa D. Bailey Walsch
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

23 .     2,3-diphenyl-2,3-dihydroquinazolin-4(1H)-one
C20H16N2O     相似度:64.7%
Indian Journal of Chemistry Section B          2007          46B          664-668
On the reaction of anthranilic acid with thionyl chloride : Iminoketene intermediate formation
Jacob,Dominic E; Mathew,Lopez
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

24 .     ethyl 4-(2-chlorophenyl)-6-phenyl-3,4-dihydropyrimidin-2(1H)-one-5-carboxylate
C19H15ClN2O3     相似度:64.7%
Heterocycles          2008          76          715-726
Oxidative Conversion of Functionalized 3, 4-Dihydopyrimidin-2(1H)-ones to the Corresponding Pyrimidin-2(1H)-ones Using Activated Carbon-Molecular Oxygen System
Ken-ichi Okunaga, Yukiko Nomura, Kenjiro Kawamura, Natsuki Nakamichi, Kazuo Eda, and Masahiko Hayashi
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

25 .     trans-3-(diallylamino)-4,6-diphenyl-3,4-dihydropyran-2-one
C23H23NO2     相似度:64.7%
Heterocycles          2007          72          553-565
Efficient Synthesis of Substituted 3-Amino-3, 4-dihydropyran-2-ones Diastereo and Enantioselective Tandem Michael Addition and Lactonization between α, β-Unsaturated Ketones and Glycine-Derived Silyl Enolates Using a Chiral Quaternary Ammonium Phenoxide
Hitoshi Nagao, Yoshinobu Yamane, and Teruaki Mukaiyama
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

26 .     2-amino-3-benzyl-5-(phenylethynyl)pyrazine
C19H15N3     相似度:64.7%
Heterocycles          2005          65          843-856
Novel Synthetic Route of Coelenterazines -2-: Synthesis of Various Dehydrocoelenterazine Analogs
Nobuhiro Kondo, Masaki Kuse, Thumnoon Mutarapat, Nopporn Thasana, and Minoru Isobe*
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

27 .     Compound(R)-4e
C19H16BrN5     相似度:64.7%
Bioorganic & Medicinal Chemistry Letters          2009          19          2203-2205
Synthesis and biological evaluation of new enantiomerically pure azole derivatives as inhibitors of Mycobacterium tuberculosis
Daniele Castagnolo, Marco Radi, Filippo Dessì, Fabrizio Manetti, Manuela Saddi, Rita Meleddu, Alessandro De Logu, Maurizio Botta
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

28 .     Compound 5
    相似度:64.7%
Magnetic Resonance in Chemistry          2002          40          747-751
A 13C NMR study of the methylol derivatives of 2, 4'-and 4, 4'-dihydroxydiphenylmethanes found in resol phenol–formaldehyde resins
Thomas H. Fisher, Ping Chao, Cindy G. Upton and Anthony J. Day
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

29 .     (2E)-1-[3-(2-Chlorophenyl)prop-2-enyl]-4-(2-methoxyphenyl)piperazine
    相似度:64.7%
Archiv der Pharmazie          2007          340          456-465
1-Cinnamyl-4-(2-methoxyphenyl)piperazines: Synthesis,Binding Properties,and Docking to Dopamine (D2) and Serotonin (5-HT1A) Receptors
Jelena Penjišević, Vladimir Šukalović, Deana Andrić, Sladjana Kostić-Rajačić, Vukić Šoškić and Goran Roglić
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

30 .     9-(3-Chloropropoxy)-1,5-dichloroanthracene
C17H13OCl3     相似度:64.7%
Archiv der Pharmazie          2002          335          33-38
Synthesis and Cytotoxicity of 9-Alkoxy-1,5-dichloroanthracene Derivatives in Murine and Human Cultured Tumor Cells
Hsu-Shan Huang, Jeng-Fong Chiou, Hui-Fen Chiu, Rong-Fu Chen and Yu-Liang Lai
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

31 .     compound 28b
    相似度:64.7%
Bioorganic & Medicinal Chemistry          1998          6          1185-1208
Design, synthesis and biological evaluation of nonpeptide integrin antagonists
K.C. Nicolaou, John I. Trujillo, Bernd Jandeleit, Kelly Chibale, M. Rosenfeld, B. Diefenbach, D.A. Cheresh, S.L. Goodman
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

32 .     compound 14
C20H21N3O     相似度:64.7%
European Journal of Organic Chemistry          2012                   2013-2022
Facile Construction of [6,6]-, [6,7]-, [6,8]-, and [6,9]Ring-Fused Triazole Frameworks by Copper-Catalyzed, Tandem, One-Pot, Click and Intramolecular Arylation Reactions: Elaboration to Fused Pentacyclic Derivatives
M. Nagarjuna Reddy and K. C. Kumara Swamy
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

33 .     6-chloro-3-[(1E,3E)-4-phenylbuta-1,3-dienyl]-2H-chromene
C19H14Cl2O     相似度:64.7%
Bioorganic & Medicinal Chemistry          2010          18          6480-6488
New 4H-chromen-4-one and 2H-chromene derivatives as anti-picornavirus capsid-binders
Cinzia Conti, Nicoletta Desideri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

34 .     6-chloro-3-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-2H-chromene
C19H14Cl2O     相似度:64.7%
Bioorganic & Medicinal Chemistry          2010          18          6480-6488
New 4H-chromen-4-one and 2H-chromene derivatives as anti-picornavirus capsid-binders
Cinzia Conti, Nicoletta Desideri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

35 .     N-(3-chloro-4-methoxyphenylethyl)phenylacetamide
    相似度:64.7%
Bioorganic & Medicinal Chemistry          2009          17          4968-4980
Tetrahydroisoquinolines as dopaminergic ligands: 1-Butyl-7-chloro-6-hydroxy-tetrahydroisoquinoline, a new compound with antidepressant-like activity in mice
Inmaculada Berenguer, Noureddine El Aouad, Sebastián Andujar, Vanessa Romero, Fernando Suvire, Thomas Freret, Almudena Bermejo, María Dolores Ivorra, Ricardo D. Enriz, Michel Boulouard, Nuria Cabedo, Diego Cortes
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

36 .     6-methyl-4-trifluoromethyl-1,3-diphenyl-1H-pyrazolo[3,4-b]pyridine
C20H14F3N3     相似度:64.7%
Russian Journal of Organic Chemistry          2008          44          251-256
α-aminoazoles in synthesis of heterocycles: III. 4-trifluoromethylpyrazolo[3,4-b]pyridines: Synthesis and structure
E. E. Emelina, A. A. Petrov, S. I. Selivanov and D. V. Filyukov
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

37 .     ethyl 2-allyl-3,4-diphenyl-3(E)-butenoate
C21H22O2     相似度:64.7%
Tetrahedron          2012          68          2719-2724
CuCl-catalyzed stereoselective conjugate addition of Grignard reagents to 2,3-allenoates
Jian He, Zhan Lu, Guobi Chai, Chunling Fu, Shengming Ma
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

38 .     (S)-methyl 1-(4-chlorophenyl)-2-methylene-3-oxobutyl(tosyl)carbamate
C20H20NClO5S     相似度:64.7%
European Journal of Organic Chemistry          2011                   4479-4484
Novel Quinidine-Derived Organocatalysts for the Asymmetric Substitutions of O-Boc-Protected Morita–Baylis–Hillman Adducts
Cheng-Kui Pei, Xiu-Chun Zhang and Min Shi
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

39 .     14-(3-chlorophenyl)-14H-dibenzo[a,j]xanthene
C27H17ClO     相似度:64.7%
Molecules          2012          17          7543-7555
Design, Synthesis and Antiviral Potential of 14-Aryl/Heteroaryl-14H-dibenzo[a,j]xanthenes Using an Efficient Polymer-Supported Catalyst
Kalla Reddi Mohan Naidu, Balam Satheesh Krishna, Mungara Anil Kumar, Palanisamy Arulselvan, Shaik Ibrahim Khalivulla and Ola Lasekan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

40 .     1-benzyl-6,6-dimethyl-3-phenyl-6,7-dihydro-1H-indazol-4(5H)-one
C22H22N2O     相似度:64.7%
European Journal of Organic Chemistry          2010                   3815-3822
Orthogonal Regioselective Synthesis of N-Alkyl-3-substituted Tetrahydroindazolones
Jonghoon Kim, Heebum Song and Seung Bum Park
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

41 .     (-)-(R)-11-hydroxyaporphine
C17H18ClNO     相似度:64.7%
Journal of Medicinal Chemistry          1995          38          647-658
(R)-11-Hydroxy- and (R)-11-Hydroxy-10-methylaporphine: Synthesis, Pharmacology, and Modeling of D2A and 5-HT1A Receptor Interactions
Martin H. Hedberg, Anette M. Johansson, Gunnar Nordvall, Ari Yliniemela, Hong Bing Li, Arnold R. Martin, Stephan Hjorth, Lena Unelius, Staffan Sundell, Uli Hacksell
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

42 .     2-(p-chlorophenyl)-3-phenyl-4,5,7-trifluorobenzofuran
C20H10OF3Cl     相似度:64.7%
Heterocycles          2012          86          1103-1118
RHODIUM-CATALYZED SYNTHESIS OF BENZOFURANS BY THE REACTION OF KETONES AND o-DIFLUOROBENZENES
Mieko Arisawa,* Soichiro Nakane, Manabu Kuwajima, and Masahiko Yamaguchi
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

43 .     5-phenyl-2-phenylethynylnicotinic acidmethyl ester
C21H15NO2     相似度:64.7%
Tetrahedron          2013          69          1822-1829
An economical nucleophilic route toward facile synthesis of pyrano[4,3-b]quinolin-1-ones via 6-endo-dig cyclization of o-alkynylquinoline esters
Neha Sharma, Mrityunjaya Asthana, Durgesh Nandini, R.P. Singh, Radhey M. Singh
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

44 .     7-bromo-4-chloro-2-(2-chlorophenyl)-1-methyl-1H-imidazo[4,5-c]quinoline
C17H10BrCl2N3     相似度:64.7%
Bioorganic & Medicinal Chemistry          2013          21          2068-2078
Synthesis and biological evaluation of substituted imidazoquinoline derivatives as mPGES-1 inhibitors
Tomoya Shiro, Keisuke Kakiguchi, Hirotada Takahashi, Hidetaka Nagata, Masanori Tobe
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

45 .     4-phenethyl-5-phenylthieno[3,2-b]pyridin-7(4H)-one
C21H17NOS     相似度:64.7%
Tetrahedron          2013          69          3167-3181
Efficient synthesis of novel thieno[3,2-b]-, [2,3-c]- and [3,2-c]pyridones by Sonogashira coupling of bromothiophenes with terminal alkynes and subsequent intramolecular C–N bond-forming reaction
Viktor O. Iaroshenko, Sajid Ali, Tariq Mahmood Babar, Muhammad S.A. Abbasi, Vyacheslav Ya Sosnovskikh, Alexander Villinger, Andrey Tolmachev, Peter Langer
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

46 .     7-chloro-1-methoxy-3-phenyl-benzo[1,6]naphthyridine
C19H13ClN2O     相似度:64.7%
Tetrahedron          2013          69          9443-9450
Palladium-catalyzed one-pot synthesis of benzo[1,6]naphthyridines via Sonogashira coupling and annulation reactions from 2-chloroquinoline-3-carbonitriles Original Research Article
Radhey M. Singh, Ritush Kumar, Neha Sharma, Mrityunjaya Asthana
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

47 .     dl-2,2'-diphenyl-3,3'-bis(4-chlorophenylimino)-[2,2'-biindan]-1,1'-dione
C42H26Cl2N2O2     相似度:64.7%
Heterocycles          2013          87          1289-1299
Thermal and Photochemical Rearrangements of 3-Arylamino-2-phenyl-1H-inden-1-ones to N-Arylphthalimides
Masayuki Kawai, Eriko Sakanoshita, Motoko Akita, and Keiji Kobayashi*
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

48 .     (S)-methyl 2-(4-(benzamidomethyl)-1H-1,2,3-triazol-1-yl)-3-phenylpropanoate
C20H20N4O3     相似度:64.7%
Journal of Heterocyclic Chemistry          2013          50          684-688
Click Synthesis of Triazolyl Phenylalaninyl and Tyrosinyl Derivatives as New Protein Tyrosine Phosphatase Inhibitors
Lei Cui, Xiao-Peng He, Li-Xin Gao, Jia Li and Guo-Rong Chen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

49 .     Anaxagoreine
    相似度:64.7%
Fitoterapia          2011          82          637-641
A novel aporphine alkaloid from Magnolia officinalis
Zuo-Fu Guo, Xiao-Bing Wang, Jian-Guang Luo, Jun Luo, Jun-Song Wang, Ling-Yi Kong
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

50 .     2-(4-Allyl-5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-1-phenylethanone oxime
C19H18N4OS     相似度:64.7%
Bioorganic & Medicinal Chemistry          2013          23          3839-3849
New nitric oxide donating 1,2,4-triazole/oxime hybrids: Synthesis, investigation of anti-inflammatory, ulceroginic liability and antiproliferative activities
Mohamed, Abdel-Aziz, Gamal, El-Din, A.A., Abuo-Rahma, Eman, A.M., Beshr, Taha, F.S., Ali
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

51 .     3-Amino-1-(4-bromophenyl)-9,10-dihydrophenanthrene-2,4-dicarbonitrile
    相似度:64.7%
Molecules          2013          18          15704-15716
An Efficient Approach to the Synthesis of Highly Congested 9,10-Dihydrophenanthrene-2,4-dicarbonitriles and Their Biological Evaluation as Antimicrobial Agents
Hassan M. Faidallah, Khalid M. A. Al-Shaikh, Tariq R. Sobahi, Khalid A. Khan and Abdullah M. Asiri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

52 .     3-Amino-1-(thiophen-2-yl)-9,10-dihydrophenanthrene-2,4-dicarbonitrile
    相似度:64.7%
Molecules          2013          18          15704-15716
An Efficient Approach to the Synthesis of Highly Congested 9,10-Dihydrophenanthrene-2,4-dicarbonitriles and Their Biological Evaluation as Antimicrobial Agents
Hassan M. Faidallah, Khalid M. A. Al-Shaikh, Tariq R. Sobahi, Khalid A. Khan and Abdullah M. Asiri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

53 .     3-Amino-1-phenyl-9,10-dihydrophenanthrene-2,4-dicarbonitrile
    相似度:64.7%
Molecules          2013          18          15704-15716
An Efficient Approach to the Synthesis of Highly Congested 9,10-Dihydrophenanthrene-2,4-dicarbonitriles and Their Biological Evaluation as Antimicrobial Agents
Hassan M. Faidallah, Khalid M. A. Al-Shaikh, Tariq R. Sobahi, Khalid A. Khan and Abdullah M. Asiri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

54 .     N-acetyl-N-(1-(4-bromophenyl)-2,4-dicyano-9,10-dihydrophenanthren-3-yl)acetamide
    相似度:64.7%
Molecules          2013          18          15704-15716
An Efficient Approach to the Synthesis of Highly Congested 9,10-Dihydrophenanthrene-2,4-dicarbonitriles and Their Biological Evaluation as Antimicrobial Agents
Hassan M. Faidallah, Khalid M. A. Al-Shaikh, Tariq R. Sobahi, Khalid A. Khan and Abdullah M. Asiri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

55 .     N-acetyl-N-(2,4-dicyano-1-(thiophen-2-yl)-9,10-dihydrophenanthren-3-yl)acetamide
    相似度:64.7%
Molecules          2013          18          15704-15716
An Efficient Approach to the Synthesis of Highly Congested 9,10-Dihydrophenanthrene-2,4-dicarbonitriles and Their Biological Evaluation as Antimicrobial Agents
Hassan M. Faidallah, Khalid M. A. Al-Shaikh, Tariq R. Sobahi, Khalid A. Khan and Abdullah M. Asiri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

56 .     compound 143
    相似度:64.7%
Magnetic Resonance in Chemistry          1995          33          355-366
Substituent effects on 13C NMR parameters of chlorinated diphenyl ethers. A multiple linear regression analysis
Tapio Nevalainen, Erkki Kolehmainen and Esa Vilén
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

57 .     N-formyl-nornuciferin(Z)
C19H19NO3     相似度:63.1%
Planta Medica          1992          58          184-187
Zur NMR-Spektroskopie von N-Acylaporphin-Alkaloiden aus Tinospora crispa
NMR-Assignments of N-Acylaporphlne Alkaloids from Tinospora crispa
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

58 .     N-formyl-nornuciferin(E)
C19H19NO3     相似度:63.1%
Planta Medica          1992          58          184-187
Zur NMR-Spektroskopie von N-Acylaporphin-Alkaloiden aus Tinospora crispa
NMR-Assignments of N-Acylaporphlne Alkaloids from Tinospora crispa
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

59 .     2,3-dihydro-4-(4-fluorophenyl)-2-styryl-1,5-benzothiazepine
C23H18FNS     相似度:63.1%
Journal of Heterocyclic Chemistry          2004          41          399-403
A new regioselective synthesis and bioactivity of 1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one derivatives
Hong-Qing Wang,Zhao-Jie Liu,Li-Min Yang and Ming-Wu Ding
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

60 .     (±)-nuciferine
    相似度:63.1%
Tetrahedron Letters          2003          44          8149-8152
Intramolecular ortho-arylation of phenols utilized in the synthesis of the aporphine alkaloids (±)-lirinidine and (±)-nuciferine
Gregory D. Cuny
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

61 .     N-(4-(4-Phenylpiperazin-1-yl)butan-2-yl)naphthalene-2-sulfonamide
C24H29N3O2S     相似度:63.1%
Bioorganic & Medicinal Chemistry          2010          18          1665-1675
Synthesis and biological evaluation of (phenylpiperazinyl-propyl)arylsulfonamides as selective 5-HT2A receptor antagonists
Euna Yoo, Juhee Yoon, Ae Nim Pae, Hyewhon Rhim, Woo-Kyu Park, Jae Yang Kong, Hea-Young Park Choo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

62 .     (1R,14R)-10-methyl-10,11,20-triazapentacyclo[12.6.0.0(2,7).0(8,12).0(16,20)]icosa-2,4,6,11-tetraene-14-carbonitrile
C19H20N4     相似度:63.1%
Tetrahedron          2013          69          5029-5043
Synthesis of pyrazole-fused polycyclic systems via intramolecular 1,3-dipolar cycloaddition reactions
Maloy Nayak, Neeraj Rastogi, Sanjay Batra
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

63 .     ethyl 4-[3-(2-carbamoyl-4-oxoquinazolin-3(4H)-yl)prop-1-yn-1-yl]benzoate
C21H17N3O4     相似度:63.1%
Tetrahedron          2013          69          7066-7072
An efficient and selective access to 1-substituted and 3-substituted derivatives of luotonin A Original Research Article
Norbert Haider, Ge Meng, Sabine Roger, Sigrid Wank
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

64 .     compound 18
C23H21NO3S     相似度:61.9%
Tetrahedron Letters          2004          45          5167-5170
Synthesis of (±)-aporphine utilizing Pictet-Spengler and intramolecular phenol ortho-arylation reactions
Gregory D. Cuny
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

65 .     nornuciferin
    相似度:61.1%
Planta Medica          1992          58          184-187
Zur NMR-Spektroskopie von N-Acylaporphin-Alkaloiden aus Tinospora crispa
NMR-Assignments of N-Acylaporphlne Alkaloids from Tinospora crispa
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

66 .     (+)-nornuciferine
C18H19NO2     相似度:61.1%
Chemistry of Natural Compounds          1996          32          596-675
ALKALOIDS. PLANTS, STRUCTURES, PROPERTIES" Chapter 2, continued
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
--------------------------------------------------------------------------------

67 .     2-[6-Chloro-4-(2-chlorophenyl)-2-methoxyquinolin-3-yl]ethanol
C18H15NO2Cl2     相似度:61.1%
Bioorganic & Medicinal Chemistry          2011          19          1400-1408
Synthesis and biological assay of 4-aryl-6-chloro-quinoline derivatives as novel non-nucleoside anti-HBV agents
Rui-Hua Guo, Quan Zhang, Yun-Bao Ma, Xiao-Yan Huang, Jie Luo, Li-Jun Wang, Chang-An Geng,Xue-Mei Zhang, Jun Zhou, Zhi-Yong Jiang, Ji-Jun Chen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

68 .     compound 5g
C26H19Cl2NO4PS     相似度:61.1%
Journal of Heterocyclic Chemistry          2008          45          103-107


Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

69 .     compound 5h
C27H20Cl2NO3PS     相似度:61.1%
Journal of Heterocyclic Chemistry          2008          45          103-107


Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

70 .     7-amino-5-(3-chlorophenyl)-1,3-dioxo-2-phenyl-1,2,3-trihydropyrazolo[1,2-a][1,2,4]triazole-6-carbonitrile
C18H12ClN5O2     相似度:61.1%
Heterocycles          2010          81          2063-2073
Ultrasonic-Assisted One-Pot Synthesis of Pyrazolo[1,2-a][1,2,4]triazole-1,3-diones
Davood Azarifar and Razieh Nejat Yami
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

71 .     1-cyclohexyl-2-(4-hydroxyphenyl)-4,5-diphenylimidazole
    相似度:61.1%
Heterocycles          2004          63          87-93
One-Pot Synthesis of Tetra-substituted Imidazoles on Silica Gel under Microwave Irradiation
Yu Xu, Yan-Zhi Liu, Lei Rui, Lei Liu, and Qing-Xiang Guo*
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

72 .     (6R)-6-[(2S,3E)-2-(Benzyloxy)-4-phenylbut-3-en-1-yl]-5,6-dihydro-2H-pyran-2-one
C22H22O3     相似度:61.1%
Helvetica Chimica Acta          2010          93          329-338
Total Synthesis of (+)-Cryptocaryalactone and of a Diastereoisomer of (+)-Strictifolione via Ring-Closing Metathesis (RCM) and Olefin Cross-Metathesis (CM)
Gowravaram Sabitha, Bhaskar Vangala, S. Siva Sankara Reddy and Jhillu S. Yadav
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

73 .     9-Isobutoxy-1,5-dichloroanthracene
C19H18OCl2     相似度:61.1%
Archiv der Pharmazie          2002          335          33-38
Synthesis and Cytotoxicity of 9-Alkoxy-1,5-dichloroanthracene Derivatives in Murine and Human Cultured Tumor Cells
Hsu-Shan Huang, Jeng-Fong Chiou, Hui-Fen Chiu, Rong-Fu Chen and Yu-Liang Lai
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

74 .     Ethyl 2-(2-cyanoacetamido)-4-phenyl-5-(phenylazo)thiophene-3-carboxylate
C22H18N4O3S     相似度:61.1%
Zeitschrift für Naturforschung B          2011          66          585-596
Novel Phenylazo Derivatives of Condensed and Uncondensed Thiophene. Synthesis, Characterization, and Antimicrobial Studies
H. M. Gaber, M. C. Bagley, S. M. Sherif, and M. A. Sayed
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

75 .     Methyl (Z)-4-Benzyl-1-methyl-2-oxo-8-phenyl-1,2,3,4,5,6-hexahydro-1,4-diazocine-6-carboxylate
C22H24N2O3     相似度:61.1%
European Journal of Organic Chemistry          2012                   1809-1818
Preparation of New 1,4-Diazocanes as Scaffolds for Combinatorial Chemistry
Miriam Penning and Jens Christoffers
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

76 .     7-benzyl-8,9,10,11-tetrahydroindolo[2,3-c]quinolin-11-one
C22H18N2O     相似度:61.1%
Heterocycles          2000          53          905-916
Reactivity of Heterocyclic Enaminones: Regioselective Synthesis of Polyfused Indolones
Yves Blache,* Véronique Benezech, Jean-Michel Chezal, Pierre Boule, Henri Viols, Olivier Chavignon, Jean-Claude Teulade, and Jean-Pierre Chapat
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

77 .     (E)-3-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(4-nitrophenyl)-prop-2-en-1-one
C24H16ClN3O3     相似度:61.1%
Bioorganic & Medicinal Chemistry          2010          18          4965-4974
Synthesis of novel pyrazolic analogues of chalcones and their 3-aryl-4-(3-aryl-4, 5-dihydro-1H-pyrazol-5-yl)-1-phenyl-1H-pyrazole derivatives as potential antitumor agents
Braulio Insuasty, Alexis Tigreros, Fabián Orozco, Jairo Quiroga, Rodrigo Abonía, Manuel Nogueras, Adolfo Sanchez, Justo Cobo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

78 .     6-bromo-2-methoxy-3-(phenyl-piperidin-1-yl-methyl)-quinoline
    相似度:61.1%
Bioorganic & Medicinal Chemistry          2009          17          2830-2841
Design, synthesis, biological evaluation and molecular modelling studies of novel quinoline derivatives against Mycobacterium tuberculosis
Ram Shankar Upadhayaya, Jaya Kishore Vandavasi, Nageswara Rao Vasireddy, Vivek Sharma, Shailesh S. Dixit, Jyoti Chattopadhyaya
Structure      13C NMR   碳谱模拟图
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79 .     5-(3-acetylphenyl)furan-2-carboxylic acid benzylamide
C20H17NO3     相似度:61.1%
European Journal of Organic Chemistry          2011                   4373-4385
Palladium-Catalyzed Direct Arylations of Five-Membered Heteroarenes Bearing N-Monoalkylcarboxamide Substituents
Nouria Laidaoui, Julien Roger, Abdellah Miloudi, Douniazad El Abed and Henri Doucet
Structure      13C NMR   碳谱模拟图
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80 .     compound 4c
C23H18BrN5O2     相似度:61.1%
European Journal of Organic Chemistry          2010                   694-704
N-Phenyl-1,2,4-triazoline-3,5-dione (PTAD) as a Dienophilic Dinitrogen Equivalent: A Simple Synthesis of 3-Amino-1,2,4-benzotriazines from Arylcarbodiimides
Mateo Alajarin, Baltasar Bonillo, Marta Marin-Luna, Pilar Sanchez-Andrada and Angel Vidal
Structure      13C NMR   碳谱模拟图
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81 .     (-)-(R)-11-hydroxy-10-methylaporphine
    相似度:61.1%
Journal of Medicinal Chemistry          1995          38          647-658
(R)-11-Hydroxy- and (R)-11-Hydroxy-10-methylaporphine: Synthesis, Pharmacology, and Modeling of D2A and 5-HT1A Receptor Interactions
Martin H. Hedberg, Anette M. Johansson, Gunnar Nordvall, Ari Yliniemela, Hong Bing Li, Arnold R. Martin, Stephan Hjorth, Lena Unelius, Staffan Sundell, Uli Hacksell
Structure      13C NMR   碳谱模拟图
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82 .     ethyl 6-methyl-4-[(E)-styryl]qunoline-1(4H)-carboxylate
C21H21NO2     相似度:61.1%
Heterocycles          2012          86          267-280
Reissert-like Alkenylation of Azaaromatic Compounds with Alkenylzirconocene Chloride Complexes
Akio Saito,* Kohei Sudo, Koichi Iimura, Miki Hayashi, and Yuji Hanzawa
Structure      13C NMR   碳谱模拟图
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83 .     3-benzoyl-6-cyano-2-phenylbenzofuran
C22H13O2     相似度:61.1%
Heterocycles          2012          86          1103-1118
RHODIUM-CATALYZED SYNTHESIS OF BENZOFURANS BY THE REACTION OF KETONES AND o-DIFLUOROBENZENES
Mieko Arisawa,* Soichiro Nakane, Manabu Kuwajima, and Masahiko Yamaguchi
Structure      13C NMR   碳谱模拟图
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84 .     N3,N11-bis(2-hydroxyethyl)-14-phenyl-14H-dibenzo[a,j]xanthene-3,11-dimethanamine
C33H33N2O3     相似度:61.1%
Chemical & Pharmaceutical Bulletin          2013          69          167-175
Design, Synthesis and Anticancer Activity of N3,N11-Bis(2-hydroxyethyl)-14-aryl-14H-dibenzo[a,j]xanthenes-3,11-dicarboxamide
Yongbin Song, Yihui Yang, Jun You, Bo Liu, Lijun Wu, Yunlong Hou, Wenji Wang, Jiuxin Zhu
Structure      13C NMR   碳谱模拟图
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85 .     3-phenyl-1-tosyl-1H-indole-2-carbaldehyde
    相似度:61.1%
Tetrahedron          2013          69          7471-7480
Metal-free synthesis of 1H-indole-2-carbaldehydes by N-iodosuccinimide-mediated cyclization of 1-(2′-anilinyl)prop-2-yn-1-ols in water. A formal synthesis of (R)-calindol Original Research Article
Prasath Kothandaraman, Sherman Jun Liang Lauw, Philip Wai Hong Chan
Structure      13C NMR   碳谱模拟图
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86 .     1-benzyl-4-phenyl-1H-[1,2,3]triazolo[4,5-c]quinoline)
C22H16N4     相似度:61.1%
Tetrahedron          2013          69          8547-8558
A strategy to access fused triazoloquinoline and related nucleoside analogues
Kapil Upadhyaya, Arya Ajay, Rohit Mahar, Renu Pandey, Brijesh Kumar, Sanjeev K. Shukla, Rama Pati Tripathi
Structure      13C NMR   碳谱模拟图
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87 .     6,8-dibromo-3-(3-p-tolyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)-2H-chromen-2-one
C20H12Br2N4O2S     相似度:61.1%
Journal of Heterocyclic Chemistry          2013          50          159-163
Synthesis of Coumarin Substituted Triazolothiadiazine Derivatives via Ring Transformation Reaction
Venkata Sreenivasa Rao Chunduru and Vedula Rajeswar Rao
Structure      13C NMR   碳谱模拟图
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88 .     (7E)-2-amino-7-benzylidene-4,5,6,7-tetrahydro-4-phenyl-cyclopentapyran-3-carbonitrile
C22H18N2O     相似度:61.1%
Journal of Heterocyclic Chemistry          2013          50          625-629
Synthesis of Novel Pyrano[2,3-b]pyridines from α,α′-Bis(substituted-benzylidene)cycloalkanones
Mohammad Ali Bigdeli, Katayon Marjani, Elinaz Farokhi, Enayatollah Sheikhhosseini and Dadkhoda Ghazanfari
Structure      13C NMR   碳谱模拟图
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89 .     3-(naphthalen-2-yl)-2H-benzo[1,4]oxazin-2-one
C18H11NO2     相似度:61.1%
Journal of Heterocyclic Chemistry          2013          50          1146-1151
An Efficient Synthetic Protocol for Quinoxalinones, Benzoxazinones, and Benzothiazinones from 2-Oxo-2-aryl-acetyl Bromide Precursors
Muthupandi Nagaraj, Sithuraj Sathiyamoorthy, Muthusamy Boominathan, Shanmugam Muthusubramanian and Nattamai Bhuvanesh
Structure      13C NMR   碳谱模拟图
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90 .     N-acetyl-nornuciferin(Z)
C20H21NO3     相似度:60%
Planta Medica          1992          58          184-187
Zur NMR-Spektroskopie von N-Acylaporphin-Alkaloiden aus Tinospora crispa
NMR-Assignments of N-Acylaporphlne Alkaloids from Tinospora crispa
Structure      13C NMR   碳谱模拟图
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91 .     N-demethyl-2-methoxyatherosperminine
C20H23NO3     相似度:60%
Fitoterapia          2008          79          308-310
New phenantrene alkaloids from Cryptocarya crassinervia
Khalijah Awang , A. Hamid A. Hadi, Nurdin Saidi, Mat Ropi Mukhtar,Hiroshi Morita, Marc Litaudon
Structure      13C NMR   碳谱模拟图
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92 .     2,3-dihydro-1,3-dioxo-7-phenyl-2-(phenylmethyl)-4-(1-pyrrolidinyl)-1H-isoindole-5-carbonitrile
C26H21N3O2     相似度:60%
Heterocycles          2009          77          617-628
Diels-Alder Reaction of 2-(Cyclic Amino)-substituted 3-Furancarbonitriles with Maleimides to Phthalimides
Hiroshi Maruoka, Fumi Okabe, Yoshimichi Koutake, Toshihiro Fujioka, and Kenji Yamagata
Structure      13C NMR   碳谱模拟图
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93 .     3-(Naphthalen-2-yl)-2H-chromene-4-carbonitrile
C20H13NO     相似度:60%
Heterocycles          2011          83          1355-1361
Convenient One-Pot Synthesis of 3-Aryl-2H-chromene-4-carbonitriles via a Tandem O-Alkylation-Knoevenagel Condensatioin
Yanhong Chen, Haoyue Xiang, Yuyuan Xie, and Chunhao Yang*
Structure      13C NMR   碳谱模拟图
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94 .     9-Chloro-5,6,6a,7-tetrahydro-6-p-toluenesulfonyl-4H-dibenzo[de,g]quinolin-1-ol
C23H20ClNO3S     相似度:60%
Tetrahedron          2012          68          1674-1681
Monoligated Pd(0)-catalyzed intramolecular ortho- and para-arylation of phenols for the synthesis of aporphine alkaloids. Synthesis of (−-lirinine
Malik Hellal, Shambhavi Singh, Gregory D. Cuny
Structure      13C NMR   碳谱模拟图
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95 .     drupanin
C14H16O3     相似度:60%
Bioorganic & Medicinal Chemistry          2010          18          151-157
Inhibitory activity of Brazilian green propolis components and their derivatives on the release of cys-leukotrienes
Hiroko Tani, Keiko Hasumi, Tomoki Tatefuji, Ken Hashimoto, Hiroyuki Koshino, Shunya Takahashi
Structure      13C NMR   碳谱模拟图
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96 .     drupanin phenylethyl ester
C22H24O3     相似度:60%
Bioorganic & Medicinal Chemistry          2010          18          151-157
Inhibitory activity of Brazilian green propolis components and their derivatives on the release of cys-leukotrienes
Hiroko Tani, Keiko Hasumi, Tomoki Tatefuji, Ken Hashimoto, Hiroyuki Koshino, Shunya Takahashi
Structure      13C NMR   碳谱模拟图
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97 .     N-[2-(4-hydroxyphenyl)ethyl]-2-{3-oxo-2H-benzo[1,4]oxazin-4(3H)-yl}-2-phenylacetamide
C24H22N2O4     相似度:60%
European Journal of Organic Chemistry          2011                   100-109
Tandem Ugi MCR/Mitsunobu Cyclization as a Short, Protecting-Group-Free Route to Benzoxazinones with Four Diversity Points
Luca Banfi, Andrea Basso, Lorenzo Giardini, Renata Riva, Valeria Rocca and Giuseppe Guanti
Structure      13C NMR   碳谱模拟图
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98 .     6-butylthio-2-(p-chlorophenyl)-3-phenyl-4,5,7-trifluorobenzofuran
C24H18OSF3Cl     相似度:60%
Heterocycles          2012          86          1103-1118
RHODIUM-CATALYZED SYNTHESIS OF BENZOFURANS BY THE REACTION OF KETONES AND o-DIFLUOROBENZENES
Mieko Arisawa,* Soichiro Nakane, Manabu Kuwajima, and Masahiko Yamaguchi
Structure      13C NMR   碳谱模拟图
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99 .     N-cyclohexyl-4,5-dihydro-5-(2,4,6-trinitrophenyl)-1,2,3-triazolo[1,5-a][1,4]benzodiazepine-6-carboxamide
C23H22N8O7     相似度:60%
Tetrahedron          2013          69          3506-3510
Synthesis of novel fused 4,5-dihydro-1,2,3-triazolo[1,5-a][1,4]benzodiazepine derivatives via four-component Ugi–Smiles-type reaction
Mina Saeedi, Mohammad Mahdavi, Alireza Foroumadi, Abbas Shafiee
Structure      13C NMR   碳谱模拟图
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100 .     1-Benzyl-2-(2-bromophenyl)-2,3-dihydroquinolin-4(1H)-one
    相似度:60%
Zeitschrift für Naturforschung B          2012          67          1021-1029
Asymmetric Brønsted Acid-catalyzed Intramolecular aza-Michael Reaction – Enantioselective Synthesis of Dihydroquinolinones
Magnus Rueping, Stefan A. Moreth and Michael Bolte
Structure      13C NMR   碳谱模拟图
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