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genghuichun

新虫 (正式写手)

[求助] 微谱求助! 已有1人参与

有两个化合物
第一个是
13C NMR (100 MHz, MeOD) δ 56.5, 61.1, 103.7, 108.8, 137.2, 138.7, 151.7, 154.9.
第二个是
13C NMR (100 MHz, MeOD) δ 95.8, 106.0, 115.9, 119.1, 120.6, 129.8, 144.1, 157.9, 163.5, 165.7, 201.0.
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lifeliuyan

至尊木虫 (职业作家)

【答案】应助回帖

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感谢参与,应助指数 +1
genghuichun: 金币+10 2014-10-15 17:53:00
查询结果:共查到96个化合物(查询结果仅供参考)
1 .     compound 5m
    相似度:75%
Chemical & Pharmaceutical Bulletin          1984          32          2622-2627
O-Methylation Effect on the Carbon-13 Nuclear Magnetic Resonance Signals of ortho-Disubstituted Phenols and Its Application to Structure Determination of New Phthalides from Aspergillus silvaticus
MASAO FUJITA,MIKIKO YAMADA,SHOICHI NAKAJIMA,KENICHI KAWAI and MASAHIRO NAGAI
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
2 .     3-[(2-hydroxyethyl)amino]-4-methoxynitrobenzene
    相似度:66.6%
Chemical Research in Toxicology          2000          13          535-540
Isolation and Identification of a New 2-Phenylbenzotriazole-Type Mutagen (PBTA-3) in the Nikko River in Aichi, Japan
Tatsushi Shiozawa, Atsuko Tada, Haruo Nukaya, Tetsushi Watanabe, Yoshifumi Takahashi, Masaharu Asanoma, Takeshi Ohe, Hiroyuki Sawanishi, Taka Katsuhara, Takashi Sugimura, Keiji Wakabayashi, and Yoshiyasu Terao
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
3 .     1,8-dihydroxy-3,6-dimethylxanthene
C15H14O3     相似度:62.5%
Natural Product Sciences          1998          4          161-169
Inhibitory Effect of Lichen Metabolites and their Synthetic Analogues on Melanin Biosynthesis in Cultured B-16 Mouse Melanoma Cells
Matubara, H.; Miharu, K.; Kinoshita, K.; Koyama, K.; Ye, Yang; Takahashi, K.; Yoshimura, I.; Yamamoto, Y.; Miura, Y.; Kinoshita, Y.
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
4 .     2',4',5'-trioxygenated flavone
    相似度:62.5%
Phytochemistry          1989          28          681-694
Natural occurrence and synthesis of 2'-oxygenated flavones,flavonols,flavanones and chalcones
Munekazu Iinuma,Mizuo Mizuno
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
5 .     4,6,4',6'-Tetrabromo-3,3'-dihydroxy-5,5'-dimethyldiphenyl Ether
C14H10Br4O3     相似度:62.5%
Chemistry & Biodiversity          2010          7          2766-2770
Induced Production of Halogenated Diphenyl Ethers from the Marine-Derived Fungus Penicillium chrysogenum
Guohua Yang, Keumja Yun, Viviane N. Nenkep, Hong Dae Choi, Jung Sook Kang and Byeng Wha Son
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
6 .     N-((perfluorobutyl)sulfonyl)-2-(3,4,5-trimethoxyphenyl)acetamide
C15H14F9NO6S     相似度:62.5%
Tetrahedron          2013          69          5634-5639
A practical method for regiocontrolled one-carbon ring contraction
Matthew J. Mitcheltree, Zef A. Konst, Seth B. Herzon
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
7 .     compound 3
    相似度:62.5%
Magnetic Resonance in Chemistry          1990          28          973-978
29Si and 13C NMR spectra of 4-substituted 2-methoxytrimethylsiloxybenzenes. Factors determining the chemical shifts in models of lignin constituents
Jan Schraml, Magdalena Kvíčalová, Václav Chvalovsky, Thomas Elder and Robert Brežny
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
8 .     2',3',4'-trioxygenated flavone
    相似度:55.5%
Phytochemistry          1989          28          681-694
Natural occurrence and synthesis of 2'-oxygenated flavones,flavonols,flavanones and chalcones
Munekazu Iinuma,Mizuo Mizuno
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
9 .     2',3',4',6'-tetraoxygenated flavone
    相似度:55.5%
Phytochemistry          1989          28          681-694
Natural occurrence and synthesis of 2'-oxygenated flavones,flavonols,flavanones and chalcones
Munekazu Iinuma,Mizuo Mizuno
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
10 .     compound 15
C24H32O9     相似度:55.5%
Heterocycles          2007          71          2113-2118
First Total Syntheses of New Phenylpropanoid Lignans, (±)-Aglacin K Stereoisomer and (±)-Arborone
Masaki Takahashi, Koji Takada, Daisuke Matsuura, Kunihiko Takabe, and Hidemi Yoda
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
11 .     compound 17
    相似度:55.5%
Tetrahedron Letters          2005          46          1867-1871
Approaches to installing a N-gem-dimethylmethylene-2-oxazolyl group and application to the synthesis of a second generation HIV protease inhibitor
Norihiro Ikemoto, Ross A. Miller, Fred J. Fleitz, Jinchu Liu, Daniel E. Petrillo, Joseph F. Leone, Joseph Laquidara, Benjamin Marcune, Sandor Karady, Joseph D. Armstrong III, Ralph P. Volante
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
12 .     1,3,6-trimethyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
    相似度:55.5%
European Journal of Organic Chemistry          2011                   6909-6915
BF3·OEt2-Mediated 1,3-Hydride Shift Followed by 6π Electrocyclization: An Efficient Route for the Synthesis of Pyridopyrimidine, Pyranoquinoline, and Phenanthroline Derivatives
Krishna C. Majumdar, Sudipta Ponra and Raj Kumar Nandi
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
13 .     methyl 5,6,7-trifluoro-3-hydroxy-1H-indazole-4-carboxylate
C9H5F3N2O3     相似度:55.5%
European Journal of Organic Chemistry          2010                   890-899
Trifluoro-3-hydroxy-1H-indazolecarboxylic Acids and Esters from Perfluorinated Benzenedicarboxylic Acids
Carlos Pérez Medina, Concepción López, Rosa M. Claramunt and José Elguero
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
14 .     methyl 4,5,7-trifluoro-3-hydroxy-1H-indazole-6-carboxylate
C9H5F3N2O3     相似度:55.5%
European Journal of Organic Chemistry          2010                   890-899
Trifluoro-3-hydroxy-1H-indazolecarboxylic Acids and Esters from Perfluorinated Benzenedicarboxylic Acids
Carlos Pérez Medina, Concepción López, Rosa M. Claramunt and José Elguero
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
15 .     2,5-dimethoxy-3,4-methylenedioxy-1-nitrobenzene
    相似度:55.5%
Australian Journal of Chemistry          2000          53          749-754
The Synthesis of Ventilone A
Matthew J. Piggott and Dieter Wege
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
16 .     2-bromo-6-methoxy-4-(methoxymethoxy)phenol
C9H11BrO4     相似度:55.5%
Helvetica Chimica Acta          2012          95          2194-2217
Synthesis and Structure Revision of Goupiolone A: A Benzotropolone Natural Product
Nobuaki Fukui, Ken Ohmori and Keisuke Suzuki
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
17 .     9-[(2-hydroxy-1-methoxyethoxy)methyl]guanine
C8H13N5O4     相似度:55.5%
Journal of Medicinal Chemistry          1991          34          2286-2294
A new class of acyclic phosphonate nucleotide analogs: Phosphonate isosteres of acyclovir and ganciclovir monophosphates as antiviral agents
Choung Un Kim, Peter F. Misco, Bing Yu Luh, Michael J. M. Hitchcock, Ismail Ghazzouli, John C. Martin
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
18 .     2-Iodo-3,5-dimethoxy-4-(methoxymethoxy)benzyl alcohol
C11H15O5I     相似度:54.5%
Heterocycles          2009          79          753-764
Synthetic Studies on Natural Isocoumarins and Isocarbostyril Derivatives Having an Alkyl Substituent at the 3-Position: Total Synthesis of Scoparines A and B, and Ruprechstyril
Marcellino Rudyanto, Koichi Kobayashi, and Toshio Honda
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
19 .     2-chloro-8-methoxy-3-methylquinoline
C11H10ClNO     相似度:54.5%
Bioorganic & Medicinal Chemistry          2012          20          6559-6578
Synthesis and structure–activity relationships of 8-substituted-2-aryl-5-alkylaminoquinolines: Potent, orally active corticotropin-releasing factor-1 receptor antagonists
Kunitoshi Takeda, Taro Terauchi, Minako Hashizume, Kohdoh Shikata, Ryota Taguchi, Kaoru Murata-Tai, Masae Fujisawa, Yoshinori Takahashi, Kogyoku Shin, Mitsuhiro Ino, Hisashi Shibata, Masahiro Yonaga
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
20 .     yangambin
    相似度:50%
Phytochemistry          2002          59          851-856
Two highly oxygenated eudesmanes and 10 lignans from Achillea holosericea
Ahmed A. Ahmed, Ahmed A. Mahmoud, Eptehal T. Ali, Olga Tzakou,Maria Couladis, Tom J. Mabry, Tamás Gátid, Gábor Tóth
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
21 .     3'-methoxy-6,7:4',5'-bis(methylenedioxy)isoflavone
C18H12O7     相似度:50%
Journal of Natural Products          2003          66          210-216
Six New Isoflavones and a 5-Deoxyflavonol Glycoside from the Leaves of Ateleia herbert-smithii
Nigel C. Veitch, Polly S. E. Sutton, Geoffrey C. Kite, and Helen E. Ireland
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
22 .     6-methoxy-7-methyl-8-oxoguanine
C7H9N5O2     相似度:50%
Journal of Natural Products          1999          62          1573-1575
6-Methoxy-7-methyl-8-oxoguanine, an Unusual Purine from the Ascidian Symplegma rubra
Brent S. Lindsay, Adaíla M. P. Almeida, Cameron J. Smith, Roberto G. S. Berlinck, Rosana M. da Rocha, and Chris M. Ireland
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
23 .     1-Ethoxycarbonylmethyl-pyridazin-1-ium bromide
    相似度:50%
Molecules          2009          14          403-411
Microwave Assisted Reactions of Some Azaheterocylic Compounds
Gheorghita Zbancioc, Vasilichia Bejan, Marian Risca, Costel Moldoveanu and Ionel I. Mangalagiu
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
24 .     4-pyridin-2-yl-2H-pyrazol-3-yl-amine
C8H8N4     相似度:50%
Molecules          2009          14          4406-4413
Studies with Azinylacetonitriles: 2-Pyridylacetonitrile as a Precursor to Functionally Substituted Pyridines
Mariam A. Al-Sheikh and Mohamed H. Elnagdi
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
2楼2014-10-15 17:48:44
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lifeliuyan

至尊木虫 (职业作家)

【答案】应助回帖

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genghuichun: 金币+10, 谢谢你! 2014-10-15 17:53:16
查询结果:共查到65个化合物(查询结果仅供参考)
1 .     (E)-2-cyano-3-(3-hydroxyphenyl)acrylamide
C10H8N2O2     相似度:63.6%
Bioorganic & Medicinal Chemistry          2011          19          7318-7337
Arylcyanoacrylamides as inhibitors of the Dengue and West Nile virus proteases
Christoph Nitsche, Christian Steuer, Christian D. Klein
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
2 .     4-(6-chloro-1H-indol-3-yl)-2-pyrimidinamine
C12H9ClN4     相似度:58.3%
Journal of Heterocyclic Chemistry          2007          44          793-801
Dimethylformamide dimethyl acetal in heterocyclic synthesis: Synthesis of polyfunctionally substituted pyridine derivatives as precursors to bicycles and polycycles
Fathi A. Abu-Shanab,A. M. Hessen and S. A. S. Mousa
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
3 .     Ammosamide B
C12H10ClN5O2     相似度:58.3%
Angewandte Chemie International Edition          2009          48          725-727
The Ammosamides: Structures of Cell Cycle Modulators from a Marine-Derived Streptomyces Species
Chambers C. Hughes, John B. MacMillan, Susana P. GaudTncio, Paul R. Jensen, and William Fenical*
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
4 .     pulicatin D
C11H8NO2S     相似度:54.5%
Journal of Natural Products          2010          73          1922-1926
Pulicatins A−E, Neuroactive Thiazoline Metabolites from Cone Snail-Associated Bacteria
Zhenjian Lin, Rowena R. Antemano, Ronald W. Hughen, Ma. Diarey B. Tianero, Olivier Peraud, Margo G. Haygood, Gisela P. Concepcion, Baldomero M. Olivera, Alan Light, and Eric W. Schmidt
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
5 .     4-(5-bromo-1H-indol-3-yl)-2-pyrimidinamine
C12H9BrN4     相似度:54.5%
Journal of Heterocyclic Chemistry          2007          44          793-801
Dimethylformamide dimethyl acetal in heterocyclic synthesis: Synthesis of polyfunctionally substituted pyridine derivatives as precursors to bicycles and polycycles
Fathi A. Abu-Shanab,A. M. Hessen and S. A. S. Mousa
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
6 .     methyl 3-(2-aminophenyl)-2-(1-aziridinylmethyl)propenoate
C13H16N2O2     相似度:54.5%
Journal of Heterocyclic Chemistry          2004          41          799-802
A new synthesis of 1,2,3,5-tetrahydroimidazo[2,3-b]-[1,3]benzodiazocines
Hyun In Cho,Seung Won Lee and Kee-Jung Lee
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
7 .     methyl 3-phenoxypyridine-4-carboxylate
C13H11NO3     相似度:54.5%
Journal of Heterocyclic Chemistry          2004          41          987-989
Nucleophilic aromatic substitution of methyl 3-nitropyridine-4-carboxylate
Jarle Holt,Freddy Tjosås,Jan M. Bakke and Anne Fiksdahl
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
8 .     compound 3
    相似度:54.5%
Journal of Heterocyclic Chemistry          2000          37          1169-1176
1-(1,2,3-triazol-4-yl)-benzimidazolones, a new series of heterocyclic derivatives
Lucia Bertelli, Giuliana Biagi, Vincenzo Calderone, Irene Giorgi, Oreste Livi, Valerio Scartoni and Pier Luigi Barili
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
9 .     (4-chlorofuro[3,2-c]quinoline)
    相似度:54.5%
Journal of Heterocyclic Chemistry          2010          47          998-1003
Carbene induced rearrangement products from two furoquinolinone scaffolds
Karl-Fredrik Lindahl, Anthony Carroll, Ronald J. Quinn and Justin A. Ripper
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
10 .     2,4-diamino-6-isoquinolylpyrimidine
C13H11N5     相似度:54.5%
Heterocycles          2005          65          2505-2511
Synthesis of Quinolyl- and Isoquinolyl Heteroarylamines Using Palladium Catalyzed Suzuki Cross-Coupling Reaction
Ihl Young Choi Lee,* Myung Hee Jung, Hee-Jeong Lim, and Hyo Won Lee*
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
11 .     compound 2
C11H8O4     相似度:54.5%
Tetrahedron Letters          2003          44          3975-3978
A practical approach for the preparation of monofunctional azulenyl squaraine dye
Wellington Pham, Ralph Weissleder, Ching-Hsuan Tung
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
12 .     phenyl (R)-1-(2-pyridinyl)ethyl ether
C13H13NO     相似度:54.5%
Heterocycles          2001          54          735-746
Stereospecific Substitution of 1-(2- Pyridinyl)ethyl Methanesulfonate with S- and O-Nucleophiles
Jun'ichi Uenishi,* Masahiro Hamada, Tomoko Takagi, and Osamu Yonemitsu
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
13 .     5-(3-chloro-4-fluorophenyl)-2-(trifluoromethyl)-1H-imidazole-4-carboxylic acid
    相似度:54.5%
Bioorganic & Medicinal Chemistry          2010          18          292-304
Application of a novel [3+2] cycloaddition reaction to prepare substituted imidazoles and their use in the design of potent DFG-out allosteric B-Raf inhibitors
Justin Dietrich, Vijay Gokhale, Xiadong Wang, Laurence H. Hurley, Gary A. Flynn
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
14 .     3-[(2-amino)pyrimidin-4-yl]-7-azaindole
C11H9N5     相似度:54.5%
Tetrahedron          2001          57          2355-2363
Synthesis of the indole alkaloids meridianins from the tunicate Aplidium meridianum
Pilar M Fresneda, Pedro Molina, Juan A Bleda
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
15 .     2-nitro-5-(4-nitrophenoxy)furan
C10H6N2O6     相似度:54.5%
Journal of Heterocyclic Chemistry          2011          48          458-462
SNAr reaction of 2,5-dinitrofuran: A mild and efficient method for the preparation of 2-aryloxy-5-nitrofuran
Sandip Gavade, Kamlesh Padiya, Swapnil Bajare, Ravi Balaskar and Dhananjay Mane
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
16 .     3-(2',4'-difluorophenyl)pyrazine-2-carbonitrile
C12H5F2N3     相似度:54.5%
Tetrahedron          2013          69          5393-5400
Synthesis of substituted diazino[c]quinolin-5(6H)-ones, diazino[c]isoquinolin-6(5H)-ones, diazino[c]naphthyridin-6(5H)-ones and diazino[c]naphthyridin-5(6H)-ones
Nathalie Fresneau, Thomas Cailly, Frédéric Fabis, Jean-Philippe Bouillon
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
17 .     2-[N-(benzoyl)amino]-4-(thiazol-2-yl)thiazole
C13H9N3OS2     相似度:54.5%
Bioorganic & Medicinal Chemistry          2013          21          6385-6397
Structure-activity relationships of 2-aminothiazoles effective against Mycobacterium tuberculosis
Anja Meissner, Helena I. Boshoff, Mahalakshmi Vasan, Benjamin P. Duckworth, Clifton E. Barry III, Courtney C. Aldrich
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
18 .     4-hydroxy-3-methylquinolin-2(1H)-one
C10H9NO2     相似度:54.5%
Tetrahedron          2013          69          10826-10835
Oxidative ring opening of 3-hydroxyquinoline-2,4(1H,3H)-diones into N-(α-ketoacyl)anthranilic acids
Stanislav Kafka, Karel Proisl, Věra Kašpárková, Damijana Urankar, Roman Kimmel, Janez Košmrlj
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
19 .     3-(2,5-Dichloropyrimidin-4-yl)pyrazolo[1,5-a]pyridine
C11H7Cl2N4     相似度:54.5%
Tetrahedron          2012          68          5434-5444
Optimized scale up of 3-pyrimidinylpyrazolo[1,5-a]pyridine via Suzuki coupling; a general method of accessing a range of 3-(hetero)arylpyrazolo[1,5-a]pyridines
Paul A. Bethel, Andrew D. Campbell, Frederick W. Goldberg, Paul D. Kemmitt, Gillian M. Lamont, Abid Suleman
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
20 .     naringenin
    相似度:54.5%
Chinese Traditional and Herbal Drugs          2012          43          1068-1070
Chemical constituents from Solanum nienkui (Ⅰ)
WU Dan; CHEN Guang-ying; HAN Chang-ri; LIU Wen-jie; YANG Huai-zhi
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
21 .     4-(2-Hydroxyphenyl)isothiazole
C9H7NOS     相似度:54.5%
Bioorganic & Medicinal Chemistry          2006          14          714-723
Design, synthesis, and antifungal activity of inhibitors of brassilexin detoxification in the plant pathogenic fungus Leptosphaeria maculans
M. Soledade. C. Pedras, Mojmir Suchy
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
22 .     N-phenyl-5-(4-nitrophenyl)-1,3,4-oxadiazol-2-amine
C14H10N4O3     相似度:54.5%
Indian Journal of Chemistry Section B          2014          53          865-870
Efficient and mild synthesis of substituted 2-amino-1,3,4-oxadiazoles mediated by (tosylimino)phenyl-λ3-iodane
Prabhu, Girish; Madhu, Chilakapathi; Sureshbabu, Vommina V
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
23 .     TT-a permethyl ether
    相似度:53.8%
Chemical & Pharmaceutical Bulletin          1984          32          5023-5026
Studies on the Constituents of Thalictrum thunbergii DC. I
EMIKO SHIMIZU,TOSHIAKI TOMIMATSU and TOSHIHIRO NOHARA
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
24 .     apigenin 7-O-β-D-glucoside
    相似度:53.8%
Phytochemistry          1986          25          1770-1771
An acylated flavone apigenin 7-O-β-D-(4″-cis-p-coumaroyl)glucoside from Echinops echinatus
Prabir K. Chaudhuri, Raghunath S. Thakur
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
25 .     apigenin
    相似度:53.8%
Chinese Traditional and Herbal Drugs          2010          41          526-529
Flavonoids from Ficus sarmentosa var. henryi
WANG Xue-gui; SHEN Li-tao; ZENG Yun-yun; TIAN Yong-qing; XU Han-hong
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
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