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wdw989新虫 (正式写手)
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[求助]
维普求助！谢谢~ 已有1人参与
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模糊查询 碳谱数据： 化合物1：13.82,17.53,18.05,99.36,101.39,110.40,111.53,139.30,149.70,161.63,164.81,166.58 化合物2：52.48,52.95,104.01,107.44,110.62,114.11,115.90,116.65,116.82,118.11,118.33,118.60,119.58,119.88,126.80,129.33,130.42,130.61,133.31,147.39,147.50, 151.22,155.22,155.50,158.44,158.67,167.76,170.60 溶剂全选 相似度>=50% |
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【答案】应助回帖
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感谢参与，应助指数 +1
wdw989: 金币+20 2014-12-03 15:03:46
感谢参与，应助指数 +1
wdw989: 金币+20 2014-12-03 15:03:46
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化合物1：13.82,17.53,18.05,99.36,101.39,110.40,111.53,139.30,149.70,161.63,164.81,166.58 1 . decarboxycitrinone C12H12O4 相似度:83.3% Journal of Natural Products 1996 59 765-769 Cercophorins A-C: Novel Antifungal and Cytotoxic Metabolites from the Coprophilous Fungus Cercophora areolata Authrine C. Whyte and James B. Gloer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 2 . 3-methyl-6-methoxy-8-hydroxyisocoumarin 相似度:58.3% The Journal of Antibiotics 1994 47 440-446 BIOSYNTHESIS OF ANTITUMOR ANTIBIOTIC, CYTOGENIN HIROYUKI KUMAGAI, MASAHIDE AMEMIYA, HIROSHI NAGANAWA, TSUTOMU SAWA, MASAAKI ISHIZUKA, TOMIO TAKEUCHI Structure 13C NMR Structure & 13C NMR 碳谱模拟图 3 . 1-(2-methoxyphenyl)butan-1-one C11H14O3 相似度:58.3% European Journal of Organic Chemistry 2006 2006 3498-3506 Metabolites from the Endophytic Fungus Nodulisporium sp. from Juniperus cedre Jingqiu Dai, Karsten Krohn, Ulrich Flörke, Siegfried Draeger, Barbara Schulz, Attila Kiss-Szikszai, Sándor Antus, Tibor Kurtán and Teunis van Ree Structure 13C NMR Structure & 13C NMR 碳谱模拟图 4 . 6-hydroxy-7-(3,3-dimethylallyloxy)coumarin 相似度:53.8% Phytochemistry 1992 31 3989-3991 6-Prenyloxy-7-methoxycoumarin, a coumarin-hemiterpene ether from Carduus tenuiflorus Luz Cardona, Begoña García, Pedro José R., José Pérez Structure 13C NMR Structure & 13C NMR 碳谱模拟图 5 . dihydrocitrinone 相似度:53.8% Archives of Pharmacal Research 2007 30 816-819 Isocoumarin derivatives from the sea squirt-derived fungus penicillium stoloniferum QY2-10 and the halotolerant fungus penicillium notatum B-52 Zhi -Hong Xin, Li -Tian, Tian -jiao Zhu, Wen -Liang Wang and Lin Du, et al. Structure 13C NMR Structure & 13C NMR 碳谱模拟图 6 . 3-cyano-4-(4-methylphenyl)-5,6-dimethyl-2(1H)-pyridone C15H14N2O 相似度:53.8% Journal of Heterocyclic Chemistry 2013 50 1272-1280 Efficient One-Pot Four-Component Synthesis and X-ray Crystallographic Structure of 2-Pyridone Derivatives Saeed Balalaie, Mohammed M. Hashemi, S. Hadi Khezri, Frank Rominger, Elmira Ghabraie and Thomas Oeser Structure 13C NMR Structure & 13C NMR 碳谱模拟图 7 . acetic acid 6,8-dihydroxy-3,5-dimethyl-1-oxo-1H-isochromen-4-ylmethyl ester C14H14O6 相似度:50% Natural Product Research 2004 18 277-285 Biologically Active Metabolites from Fungi, 19: New Isocoumarins and Highly Substituted Benzoic Acids from the Endophytic Fungus, Scytalidium SP. Karsten Krohn; Md. Hossain Sohrab; Hans-Jürgen Aust; Siegfried Draeger; Barbara Schulz Structure 13C NMR Structure & 13C NMR 碳谱模拟图 8 . 6,8-dihydroxy-4-hydroxymethyl-3,5-dimethyl-isochromen-1-one C12H12O5 相似度:50% Natural Product Research 2004 18 277-285 Biologically Active Metabolites from Fungi, 19: New Isocoumarins and Highly Substituted Benzoic Acids from the Endophytic Fungus, Scytalidium SP. Karsten Krohn; Md. Hossain Sohrab; Hans-Jürgen Aust; Siegfried Draeger; Barbara Schulz Structure 13C NMR Structure & 13C NMR 碳谱模拟图 9 . perfragilin B 相似度:50% Journal of Natural Products 1993 Vol 56 1431 Perfragilins A and B, Cytotoxic Isoquinolinequinones from the Bryozoan Membranipora perfragilis Young-Hee Choi, Aeri Park, Francis J. Schmitz, Ian van Altena Structure 13C NMR Structure & 13C NMR 碳谱模拟图 10 . Decarboxyhydroxycitrinone C12H12O5 相似度:50% Journal of Natural Products 2011 84 1645-1649 Chemical Constituents of a Marine Fungus, Arthrinium sacchari Mariko Tsukada, Miyuki Fukai, Kazuhiko Miki, Takeshi Shiraishi, Toshihiro Suzuki,Kazuto Nishio, Takashi Sugita, Masahiro Ishino, Kaoru Kinoshita, Kunio Takahashi,Motoo Shiro, and Kiyotaka Koyama Structure 13C NMR Structure & 13C NMR 碳谱模拟图 11 . 3-Butyryl-6-[rel-(1S,2S)-1,2-dihydroxypropyl]-4-hydroxy-2H-pyran-2-one C12H16O6 相似度:50% Chinese Chemical Letters 2011 22 1226-1228 Secondary metabolites from fungus Alternaria sp. CIB 108 Qian Feng Chen, Min Zhou, Tao Yang, Xiao Zhen Chen, Chun Wang, Guo Lin Zhang, Guo You Li Structure 13C NMR Structure & 13C NMR 碳谱模拟图 12 . (E)-ethyl 2-(4-amino-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-6(7H)-ylidene)-3-iminopropanoate C16H15ClN6O2 相似度:50% Archiv der Pharmazie 2011 11 184-196 Synthesis and Biological Evaluation of Some Novel Fused Pyrazolopyrimidines as Potential Anticancer and Antimicrobial Agents Heba A. Abd El Razik and Abeer E. Abdel Wahab Structure 13C NMR Structure & 13C NMR 碳谱模拟图 13 . 7-Amino-3-ethyl-4-methylquinolin-2(1H)-one C12H14N2O 相似度:50% Bioorganic & Medicinal Chemistry 2012 20 1624-1638 Substrate specificity of acetoxy derivatives of coumarins and quinolones towards Calreticulin mediated transacetylation: Investigations on antiplatelet function Abha Kathuria,Nivedita Priya,Karam Chand,Prabhjot Singh,Anjali Gupta,Sarah Jalal,Shilpi Gupta,Hanumantharao G. Raj,Sunil K. Sharma Structure 13C NMR Structure & 13C NMR 碳谱模拟图 14 . 1-(2-methoxy-6-hydroxyphenyl)tetradecan-1-one C21H34O3 相似度:50% Phytochemistry 1988 27 465-468 Arylalkanones from Myristica dactyloides N. Savitri Kumar,H.M.T.B. Herath,Veranja Karunaratne Structure 13C NMR Structure & 13C NMR 碳谱模拟图 15 . 6-(3-((2-(dimethylamino)-5-ethyl-1,6-dihydro-6-oxopyrim-idin-4-yl)methyl)benzyl)-2-(dimethylamino)-5-ethylpyrimid-in-4(3H)-one C24H32N6O2 相似度:50% Journal of Heterocyclic Chemistry 2007 44 381-387 Synthesis and anti-HIV-1 activity of 1,3-phenylene bis-uracil analogues of MKC-442 Youssef L. Aly,Erik B. Pedersen,Paolo La Colla and Roberta Loddo Structure 13C NMR Structure & 13C NMR 碳谱模拟图 16 . 6,7-dihydroxy-4-methyl-3-ethyl-2H-chromen-2-one 相似度:50% Journal of Heterocyclic Chemistry 2004 41 867-871 The synthesis of novel crown ethers,part X,4-propyl-and 3-ethyl-4-methylchromenone-crown ethers Esra Tiftikçi and ÇAkil Erk Structure 13C NMR Structure & 13C NMR 碳谱模拟图 17 . N-(4-chloro-phenyl)-3,7-dimethyl-4-oxo-4,6-dihydropyra-zolo[5,1-c][1,2,4]triazine-8-carboxamide C14H12ClN5O2 相似度:50% Journal of Heterocyclic Chemistry 2001 38 711-716 Synthesis of some novel 3,7-dimethyl-4H-pyrazolo[5,1-c][1,2,4]triazin-4-ones Ahmed A. El-Barbary, Mahmoud A. El-Badawi and Yasser M. Loksha Structure 13C NMR Structure & 13C NMR 碳谱模拟图 18 . 3,5-diethoxycarbonyl-2,6-dimethyl-4-(2-pyridyl)-1,4-dihydropyridine C18H22N2O4 相似度:50% Journal of Heterocyclic Chemistry 2000 37 1575-1581 Experimental and theoretical structural study of 2-pyridyl- and 4-hydroxyphenyl-1,4-dihydropyridine derivatives Héctor Novoa De Armas, Norbert Blaton, Oswald M. Peeters, Camiel De Ranter, Margarita Suárez, Emilio Rolando, Yamila Verdecia, Estael Ochoa, Nazario Martín, Margarita Quinteiro, Carlos Seoane and José L. Soto Structure 13C NMR Structure & 13C NMR 碳谱模拟图 19 . 3-Methoxy-N-(3-methylbutan-2-yl)aniline C12H19NO 相似度:50% Molecules 2010 15 2453-2472 Bifunctional Catalysis: Direct Reductive Amination of Aliphatic Ketones with an Iridium-Phosphate Catalyst Barbara Villa-Marcos, Chaoqun Li, Keith R. Mulholland, Philip J. Hogan and Jianliang Xiao Structure 13C NMR Structure & 13C NMR 碳谱模拟图 20 . 2-hydroxyl-4-methoxyl-6-pentylbenzoic acid C13H18O4 相似度:50% Chinese Traditional and Herbal Drugs 2004 35 1090-1093 Chemical constituents of Cladonia stellaris WANG Xiao-ling; YANG Bo-lun Structure 13C NMR Structure & 13C NMR 碳谱模拟图 21 . perfragibin B 相似度:50% Tetrahedron Letters 1993 34 3983-3984 Synthesis of perfragilin B, A cytotoxic isoquinoline quinone isolated from the bryozoan Membranipora perfragilis Aeri Park, Francis J. Schmitz Structure 13C NMR Structure & 13C NMR 碳谱模拟图 22 . compound 4h 相似度:50% Heterocycles 2011 83 2067-2077 One-Pot Synthesis of Dihydropyrimidiones via Environmentally Friendly Enzyme-Catalyzed Biginelli Reaction Wanmei Li, Guobin Zhou, Pengfei Zhang,* Yifeng Lai, and Shifu Xu Structure 13C NMR Structure & 13C NMR 碳谱模拟图 23 . methyl 1,6-dimethyl-4-(trifluoromethylsulfoxy)-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carboxylate C12H13N2O5SF3 相似度:50% Bioorganic & Medicinal Chemistry 2010 18 7628-7638 Design, synthesis, and evaluation of an α-tocopherol analogue as a mitochondrial antioxidant Jun Lu, Omar M. Khdour, Jeffrey S. Armstrong, Sidney M. Hecht Structure 13C NMR Structure & 13C NMR 碳谱模拟图 24 . 6-methyl-1-ethoxypyridine-2,4(1Н,3Н)-dione C8H11NO3 相似度:50% Russian Journal of Organic Chemistry 2011 47 277-283 Synthesis and keto-enol tautomerism of 6-alkyl-1-alkoxypyridine-2,4-diones D. B. Rubinov, I. L. Rubinova and F. A. Lakhvich Structure 13C NMR Structure & 13C NMR 碳谱模拟图 25 . cytogenin 相似度:50% The Journal of Antibiotics 1994 47 440-446 BIOSYNTHESIS OF ANTITUMOR ANTIBIOTIC, CYTOGENIN HIROYUKI KUMAGAI, MASAHIDE AMEMIYA, HIROSHI NAGANAWA, TSUTOMU SAWA, MASAAKI ISHIZUKA, TOMIO TAKEUCHI Structure 13C NMR Structure & 13C NMR 碳谱模拟图 26 . 3-methyl-6,8-dihydroxyisocoumarin 相似度:50% The Journal of Antibiotics 1994 47 440-446 BIOSYNTHESIS OF ANTITUMOR ANTIBIOTIC, CYTOGENIN HIROYUKI KUMAGAI, MASAHIDE AMEMIYA, HIROSHI NAGANAWA, TSUTOMU SAWA, MASAAKI ISHIZUKA, TOMIO TAKEUCHI Structure 13C NMR Structure & 13C NMR 碳谱模拟图 27 . 6-ethoxy-7-methoxycoumarin 相似度:50% Journal of Natural Medicines 2012 66 Collagenase inhibitors from Viola yedoensis Naohiro Oshima · Yuji Narukawa · Tadahiro Takeda ·Fumiyuki Kiuchi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 28 . 8-hydroxy-3,4-dimethyl-1H-isochromen-1-one [oospolactone] 相似度:50% Heterocycles 2012 84 983-1012 Synthesis of 8-Hydroxyisochromenes and 8-Hydroxyisocoumarins from 3-Ethoxycyclohex-2-en-1-one George Majetich* and Jeremy L. Grove Structure 13C NMR Structure & 13C NMR 碳谱模拟图 29 . 6-ethoxy-7-methoxycoumarin C12H12O4 相似度:50% Journal of Natural Medicines 2013 67 240-245 Collagenase inhibitors from Viola yedoensis Naohiro Oshima, Yuji Narukawa, Tadahiro Takeda… Structure 13C NMR Structure & 13C NMR 碳谱模拟图 30 . ethyl 4-butyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate 相似度:50% Tetrahedron 2013 69 8245-8249 β-Cyclodextrin-assisted synthesis of Biginelli adducts under solvent-free conditions Natália Aparecida Liberto, Sarah de Paiva Silva, Ângelo de Fátima, Sergio Antonio Fernandes Structure 13C NMR Structure & 13C NMR 碳谱模拟图 31 . 3-cyano-4-phenyl-5,6-dimethyl-2(1H)-pyridone C14H12N2O 相似度:50% Journal of Heterocyclic Chemistry 2013 50 1272-1280 Efficient One-Pot Four-Component Synthesis and X-ray Crystallographic Structure of 2-Pyridone Derivatives Saeed Balalaie, Mohammed M. Hashemi, S. Hadi Khezri, Frank Rominger, Elmira Ghabraie and Thomas Oeser Structure 13C NMR Structure & 13C NMR 碳谱模拟图 32 . 3,3',4,4'-tetrakis-O-triisopropylsilylellagic acid monohydrate C50H86O8Si4 相似度:50% Bioscience, Biotechnology, and Biochemistry 2013 77 810-813 Synthesis of Okicamelliaside, a Glucoside of Ellagic Acid with Potent Anti-Degranulation Activity Ryohei KOBAYASHI, Kengo HANAYA, Mitsuru SHOJI, Shigeru OHBA, Takeshi SUGAI Structure 13C NMR Structure & 13C NMR 碳谱模拟图 33 . 6,8-Dihydroxy-3-methylisocoumarin C10H8O4 相似度:50% Natural Product Communications 2011 6 45-48 Bioactive Isocoumarins from a Terrestrial Streptomyces sp. ANK302 Dhafer Saber Zinad, Khaled A. Shaaban, Muna Ali Abdalla, Md. Tofazzal Islam, Anja Schüffler and Hartmut Laatsch Structure 13C NMR Structure & 13C NMR 碳谱模拟图 34 . 3,5-Bis(ethoxycarbonyl)-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyrazine C18H21N3O6 相似度:50% Journal of Heterocyclic Chemistry 2012 49 1357-1361 New Highlights in the Synthesis of 4-Aryl-1,4-dihydropyrazines Jing-Yu He, Xiu-Qing Song, Hong Yan and Ru-Gang Zhong Structure 13C NMR Structure & 13C NMR 碳谱模拟图 35 . 6,8-Dihydroxyisocoumarin-3-carboxylic Acid C10H6O6 相似度:50% Chemical & Pharmaceutical Bulletin 2013 61 358-362 A 14-Membered Macrolide and Isocoumarin Derivatives from the Cultured Lichen Mycobionts of Graphis vestitoides Duy Hoang Le, Yukiko Takenaka, Nobuo Hamada, Hiromi Miyawaki, Takao Tanahashi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 36 . (E,E)-4,6-Bis(3,4-dimethoxystyryl)-2-chloro-pyrimidine 相似度:50% Bioorganic & Medicinal Chemistry 2013 21 5012-5020 Exploring pyrimidine-substituted curcumin analogues: Design, synthesis and effects on EGFR signaling Peiju Qiu, Lingling Xu, Lei Gao, Meng Zhang, Shixi Wang, Sheng Tong, Yue Sun, Lijuan Zhang, Tao Jiang Structure 13C NMR Structure & 13C NMR 碳谱模拟图 37 . Ethyl 2-hydroxy-7-methoxy-2-(trifluoromethyl)-2H-chromene-3-carboxylate C14H13F3O5 相似度:50% Molecules 2013 18 11964-11977 An Efficient Solvent-Free Synthesis of 2-Hydroxy-2-(trifluoromethyl)-2H-chromenes Using Silica-Immobilized L-Proline Cuilian Xu, Guoyu Yang, Caixia Wang, Sufang Fan, Lixia Xie and Ya Gao Structure 13C NMR Structure & 13C NMR 碳谱模拟图 38 . compound 1e 相似度:50% Magnetic Resonance in Chemistry 1987 25 985-986 3,6,9-trioxanthracenes and 3,6-dioxa-9-thianthracenes: Conformational analysis and complete assignment of 13C NMR spectra Marcial Moreno-Mañas, Jordi Ribas, Francisco Sánchez-Ferrando and Albert Virgili Structure 13C NMR Structure & 13C NMR 碳谱模拟图 39 . compound 9 相似度:50% Magnetic Resonance in Chemistry 1987 25 466-468 Carbon-13 chemical shifts assignment of (E)-styryluracits. (E)-styrylthiouracils and (E)-3-oxothiazolo[3,2-a]-6-styryl-pyrimidin-5-ones Andrzej Łapucha and Elzbieta Wyrzykiewicz Structure 13C NMR Structure & 13C NMR 碳谱模拟图 40 . divaricatinic acid C11H14O4 相似度:50% Acta Botanica Yunnanica 1990 12 99-106 CHEMICAL CONSTITUENTS FROM PARMELIA TINCTORUM Ding Zhihui Ding Jingkai Lou Jiafcng Zhang Guang Structure 13C NMR Structure & 13C NMR 碳谱模拟图 41 . perlatolic acid 相似度:50% Acta Botanica Yunnanica 1992 14 445-452 STUDIES ON 13C NMR OF DEPSIDE SHEN Xiao-Yu, SUN Han-Dong Structure 13C NMR Structure & 13C NMR 碳谱模拟图 化合物2： 52.48,52.95,104.01,107.44,110.62,114.11,115.90,116.65,116.82,118.11,118.33,118.60,119.58,119.88,126.80,129.33,130.42,130.61,133.31,147.39,147.50, 151.22,155.22,155.50,158.44,158.67,167.76,170.60 1 . trans-3-[6-[6-[(E)-2-Carboxyethenyl]-3-(3,4-dihydroxyphenyl)-2,3-dihydro-2-(1,4-benzodioxin)]-3,4-dihydroxyphe-nyl]-(E)-2-propenoic acid C26H21O10 相似度:57.1% Canadian Journal of Chemistry 2008 86 821-830 Biotransformation of caffeic acid by Momordica charantia peroxidase Xiang Wan, Haili Liu, Xuefeng Huang, Jianguang Luo, and Lingyi Kong Structure 13C NMR Structure & 13C NMR 碳谱模拟图 2 . 5-(4-Phenoxyphenyl)-5-(4-(6-(trifluoromethyl)nicotinoyl)-1,4-diazepan-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione C28H24F3N5O5 相似度:57.1% Bioorganic & Medicinal Chemistry 2011 19 4985-4999 N-Substituted homopiperazine barbiturates as gelatinase inhibitors Jun Wang, Carlos Medina, Marek W. Radomski, John F. Gilmer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 3 . 5-(4-Phenoxyphenyl)-5-(4-(5-fluoro-2-(methylsulfonamido)benzoyl)-1,4-diazepan-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione C29H29N5O7S 相似度:57.1% Bioorganic & Medicinal Chemistry 2011 19 4985-4999 N-Substituted homopiperazine barbiturates as gelatinase inhibitors Jun Wang, Carlos Medina, Marek W. Radomski, John F. Gilmer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 4 . compound 7d C28H26N8O4 相似度:57.1% Indian Journal of Chemistry Section B 2009 48B 88-96 Synthesis and in vitro study of biological activity of heterocyclic N-Mannich bases Shah,T B; Gupte,A; Patel,M R; Chaudhari,V S; Patel,H; Patel,V C Structure 13C NMR Structure & 13C NMR 碳谱模拟图 5 . 2-(3-(3-methoxy-5-methylphenyl)-4-(2-(4-phenoxyphenyl)pyridin-4-yl)-1H-pyrazol-1-yl)acetonitrile 相似度:57.1% Bioorganic & Medicinal Chemistry 2010 18 3961-3973 Design and synthesis of new potent anticancer pyrazoles with high FLT3 kinase inhibitory selectivity Ibrahim Mustafa El-Deeb, So Ha Lee Structure 13C NMR Structure & 13C NMR 碳谱模拟图 6 . methyl 3'-hydroxy-4-(3'-hydroxybiphenylcarbonyl)biphenyl-2-carboxylate C27H20O5 相似度:57.1% European Journal of Organic Chemistry 2011 6670-6684 Synthesis of 2′,4-Diarylbenzophenones through Site-Selective Suzuki–Miyaura Reactions of Bis(triflates) of 2′,4-Dihydroxybenzophenones Muhammad Nawaz, Ihsan Ullah, Obaid-Ur-Rahman Abid, Alexander Villinger and Peter Langer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 7 . isohopeaphenol C56H42O12 相似度:57.1% Heterocycles 1997 45 1809-1813 A New Hydroxystilbene Tetramer Named Isohopeaphenol from Vitis vinifera 'Kyohou' Junko Ito, Masatake Niwa, and Yoshiteru Oshima Structure 13C NMR Structure & 13C NMR 碳谱模拟图 8 . monoanhydrogossypol 相似度:56.6% Chemistry of Natural Compounds 1990 26 129-138 1H AND 13C NMR SPECTRA OF TRANSFORMATION PRODUCTS OF GOSSYPOL IN SOLUTIONS N. D. Abdullaev, A. A. Tyshchenko, I. P. Nazarova,N. T. Ul'chenko, M. R. Yagudaev, and A. I. Glushenkova Structure 13C NMR Structure & 13C NMR 碳谱模拟图 9 . 5-(4-Phenoxyphenyl)-5-(4-(2-(2,3-dihydrobenzo-[1,4]dioxine-6-sulfonamido)3-methylbutyryl)-1,4-diazepan-1-yl)-pyrimidine-2,4,6(1H,3H,5H)-trione C34H38N5O9S 相似度:55.1% Bioorganic & Medicinal Chemistry 2011 19 4985-4999 N-Substituted homopiperazine barbiturates as gelatinase inhibitors Jun Wang, Carlos Medina, Marek W. Radomski, John F. Gilmer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 10 . clerodendranoic acid C29H26O12 相似度:55.1% Molecules 2012 17 13656-13661 Clerodendranoic Acid, a New Phenolic Acid from Clerodendranthus spicatus Qingxia Zheng, Zhaocui Sun, Xiaopo Zhang, Jinquan Yuan, Haifeng Wu, Junshan Yang and Xudong Xu Structure 13C NMR Structure & 13C NMR 碳谱模拟图 11 . hyrtimomine E C29H22N5O5S 相似度:55.1% Tetrahedron Letters 2013 54 4038-4040 Hyrtimomines D and E, bisindole alkaloids from a marine sponge Hyrtios sp. Naonobu Tanaka, Rei Momose, Yohei Takahashi, Takaaki Kubota, Azusa Takahashi-Nakaguchi, Tohru Gonoi, Jane Fromont, Jun’ichi Kobayashi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 12 . Methyl 2-acetamido-4-(2-acetamido-4-(2-acetamido-5-methoxy-4-nitrobenzamido)-5-methoxybenzamido)-5-methoxybenzoate C31H32N6O12 相似度:54.8% Tetrahedron 2012 68 4501-4505 Double-sided α-helix mimetics Sam Thompson, Ramakrishnan Vallinayagam, Marc J. Adler, Richard T.W. Scott, Andrew D. Hamilton Structure 13C NMR Structure & 13C NMR 碳谱模拟图 13 . maduranic acid benzhydrazone 相似度:54.8% The Journal of Antibiotics 1999 52 1029-1041 Semisynthetic Derivatives of Madurahydroxylactone and Their Antibacterial Activities LOTHAR HEINISCH, ERNST ROEMER, PETER JüTTEN, WOLFGANG HAAS, WALTER WERNER, UTE MÖLLMANN Structure 13C NMR Structure & 13C NMR 碳谱模拟图 14 . cis-3-[6-[5-[(E)-2-Carboxyethenyl]-2,3-dihydro-2-(3,4-dihydroxyphenyl)-7-hydroxy-3-benzofuranyl]-3,4-dihydroxyphenyl]-(E)-2-propenoic acid C26H21O10 相似度:53.5% Canadian Journal of Chemistry 2008 86 821-830 Biotransformation of caffeic acid by Momordica charantia peroxidase Xiang Wan, Haili Liu, Xuefeng Huang, Jianguang Luo, and Lingyi Kong Structure 13C NMR Structure & 13C NMR 碳谱模拟图 15 . 5-(4-Phenoxyphenyl)-5-(4-(2,5-diethoxybenzoyl)-1,4-diazepan-1-yl) pyrimidine-2,4,6(1H,3H,5H)-trione C32H35N4O7 相似度:53.5% Bioorganic & Medicinal Chemistry 2011 19 4985-4999 N-Substituted homopiperazine barbiturates as gelatinase inhibitors Jun Wang, Carlos Medina, Marek W. Radomski, John F. Gilmer Structure 13C NMR Structure & 13C NMR 碳谱模拟图 16 . gneafricanin A C29H22O8 相似度:53.5% Heterocycles 2002 57 1057-1062 Dimeric Stilbenes from Stem Lianas of Gnetum africanum Ibrahim Iliya, Toshiyuki Tanaka,* Munekazu Iinuma, Zulfiqar Ali, Miyuki Furasawa, and Ken-ichi Nakaya Structure 13C NMR Structure & 13C NMR 碳谱模拟图 17 . N-(3',6'-di(trimethylacetyloxy)-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)-N'-phenylurea C37H34N2O8 相似度:53.5% Bioorganic & Medicinal Chemistry 2010 18 7034-7042 A fluorescein-containing, small-molecule, water-soluble receptor for cytosine free bases Yu Lin Jiang, Puneet Patel, Suzane M. Klein Structure 13C NMR Structure & 13C NMR 碳谱模拟图 18 . 1-(2-carboxy-4-hydroxyphenyl)-E-4-(4-hydroxy-3-methoxybenzylidene)-2-(4-hydroxy-3-methoxy-phenyl)-5-oxopyrrolidine-3-carboxylic acid C27H24NO10 相似度:53.5% Tetrahedron 2004 60 4765-4771 Identification of a dehydrodimer of avenanthramide phytoalexin in oats Yozo Okazaki, Atsushi Ishihara, Takaaki Nishioka, Hajime Iwamura Structure 13C NMR Structure & 13C NMR 碳谱模拟图 19 . [3,4,5,6-(13)C4] 1-(2-carboxy-4-hydroxyphenyl)-E-4-(4-hydroxy-3-methoxybenzylidene)-2-(4-hydroxy-3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid 相似度:53.5% Tetrahedron 2004 60 4765-4771 Identification of a dehydrodimer of avenanthramide phytoalexin in oats Yozo Okazaki, Atsushi Ishihara, Takaaki Nishioka, Hajime Iwamura Structure 13C NMR Structure & 13C NMR 碳谱模拟图 20 . 1-(4-(7-(2-hydroxy-3-(phenylamino)propoxy)-2H-chromen-3-yl)phenoxy)-3-(phenylamino)propan-2-ol C33H34N2O5 相似度:53.5% Bioorganic & Medicinal Chemistry 2013 21 1652-1660 Synthesis of novel isoflavene–propranolol hybrids as anti-tumor agents Eugene M.H. Yee, Eddy Pasquier, George Iskander, Kasey Wood, David StC Black, Naresh Kumar Structure 13C NMR Structure & 13C NMR 碳谱模拟图 21 . riccardin I C28H22O6 相似度:53.5% Chinese Chemical Letters 2013 24 801-803 Antifungal variant bis(bibenzyl)s from the liverwort Asterella angusta Jian-Bo Qu, Ling-Mei Sun, Hong-Xiang Lou Structure 13C NMR Structure & 13C NMR 碳谱模拟图 22 . (2S,3S)-3-(3,4-dihydroxyphenyl)-6-((Z)-3-(3,4-dihydroxystyryloxy)-3-oxoprop-1-enyl)-2,3-dihydrobenzo[1,4]dioxine-2-carboxylic acid C26H20O10 相似度:53.5% Phytochemistry 2014 101 121-127 Neolignans as xanthine oxidase inhibitors from Hyptis rhomboides Sheng-Fa Tsai, Shoei-Sheng Lee Structure 13C NMR Structure & 13C NMR 碳谱模拟图 23 . (2S,3S)-methyl 3-(3,4-dihydroxyphenyl)-6-((Z)-3-(3,4-dihydroxyst-yryloxy)-3-oxoprop-1-enyl)-2,3-dihydrobenzo[1,4]dioxine-2-carboxylate C27H22O10 相似度:53.5% Phytochemistry 2014 101 121-127 Neolignans as xanthine oxidase inhibitors from Hyptis rhomboides Sheng-Fa Tsai, Shoei-Sheng Lee Structure 13C NMR Structure & 13C NMR 碳谱模拟图 24 . 3'-O-(8''-Z-caffeoyl)rosmarinicacidmethylester 相似度:53.5% Chinese Pharmaceutical Journal 2014 49 22-25 Water-soluble Constituents of Clerodendranthus spicatus SUN Zhao-cui, ZHENG Qing-xia, WU Hai-feng, MA Guo-xu, XU Xu-dong*, YANG Jun-shan( Structure 13C NMR Structure & 13C NMR 碳谱模拟图 25 . orthosiphoic acid D C27H22O11 相似度:53.5% Phytochemistry Letters 2014 8 16-21 Four new phenolic acids from Clerodendranthus spicatus Zhaocui Sun, Qingxia Zheng, Guoxu Ma, Xiaopo Zhang, Jingquan Yuan, Haifeng Wu, Huiling Liu, Junshan Yang, Xudong Xu Structure 13C NMR Structure & 13C NMR 碳谱模拟图 26 . Gnetumontanin F C23H18O7 相似度:53.5% Phytochemistry 2011 72 495-502 Estrogenic and anti-estrogenic compounds from the Thai medicinal plant, Smilax corbularia (Smilacaceae) Boonsong Wungsintaweekul, Kaoru Umehara, Toshio Miyase, Hiroshi Noguchi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 27 . 2-(4-Methoxyphenylamino)-N-((1-(3-phenoxybenzyl)-1H-1,2,3-triazol-4-yl)methyl) nicotinamide C29H27O3N6 相似度:53.5% Bioorganic & Medicinal Chemistry 2014 22 3465-3477 Synthesis and evaluation of N-((1-benzyl-1H-1,2,3-triazol-4-yl)methyl)nicotinamides as potential anticancer agents that inhibit tubulin polymerization Ahmed Kamal, N.V. Subba Reddy, V. Lakshma Nayak, Narasimha Rao Bolla, A.V. Subba Rao, B. Prasad Structure 13C NMR Structure & 13C NMR 碳谱模拟图 28 . 2-(2,4-Dimethoxyphenylamino)-N-((1-(3-phenoxybenzyl)-1H-1,2,3-triazol-4-yl)methyl)nicotinamide C30H28O4N6 相似度:53.5% Bioorganic & Medicinal Chemistry 2014 22 3465-3477 Synthesis and evaluation of N-((1-benzyl-1H-1,2,3-triazol-4-yl)methyl)nicotinamides as potential anticancer agents that inhibit tubulin polymerization Ahmed Kamal, N.V. Subba Reddy, V. Lakshma Nayak, Narasimha Rao Bolla, A.V. Subba Rao, B. Prasad Structure 13C NMR Structure & 13C NMR 碳谱模拟图 29 . 2-(4-Methylphenyl)-9-[(4-phenoxyphenyl)ethynyl]-2,6-dihydro[1,2,4] triazolo[4,3-c]-quinazoline-3,5-dione C30H20N4O3 相似度:53.3% Bioorganic & Medicinal Chemistry 2011 19 111-121 Triazoloquinazolinediones as novel high affinity ligands for the benzodiazepine site of GABAA receptors Jakob Nilsson, Ritha Gidlöf, Elsebet Østergaard Nielsen, Tommy Liljefors, Mogens Nielsen,Olov Sterner Structure 13C NMR Structure & 13C NMR 碳谱模拟图 30 . isombamichalcone C30H26O8 相似度:53.3% Tetrahedron Letters 1989 30 1807-1810 Structures of isombamichalcone and lophirochalcone, bi- and tetra-flavonoids from lophira lanceolata R. Ghogomu Tih, B.L. Sondengam, M.T. Martin, B. Bodo Structure 13C NMR Structure & 13C NMR 碳谱模拟图 31 . 2-(5-fluoro-2-isopropoxyphenyl)-8,9-dimethoxy-1-(4-methoxyphenyl)-5,6-dihydropyrrolo[2,1-a] isoquinoline C30H30FNO4 相似度:53.3% European Journal of Medicinal Chemistry 2010 45 11-18 Novel hybrids from lamellarin D and combretastatin A 4 as cytotoxic agents Li Shen, Xiaochun Yang, Bo Yang, Qiaojun He, Yongzhou Hu Structure 13C NMR Structure & 13C NMR 碳谱模拟图 32 . 6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]chromone C17H14O4 相似度:51.7% Chemical & Pharmaceutical Bulletin 2002 50(3) 419-422 Six New 2-(2-Phenylethyl)chromones from Agarwood Tenji KONISHI,Takao KONOSHIMA, Yasuo SHIMADA,and Shiu KIYOSAWA Structure 13C NMR Structure & 13C NMR 碳谱模拟图 33 . (7R,8S)-3'-O-methylcedrusin 9-p-coumarate C29H30O8 相似度:51.7% Journal of Natural Products 2005 68 1175-1179 Lignans from Bark of Larix olgensis var. koreana Bao-Hua Yang, Wei-Dong Zhang, Run-Hui Liu, Ting-Zhao Li, Chuan Zhang, Yun Zhou, and Juan Su Structure 13C NMR Structure & 13C NMR 碳谱模拟图 34 . lithospermic acid monomethylester 相似度:51.7% Chemical & Pharmaceutical Bulletin 1989 37 1287-1290 Isolation of Inhibitors of Adenylate Cyclase from Dan-shen, the Root of Salvia miltiorrhiza Hiroshi KOHDA,Osamu TAKEDA,Seiji TANAKA,Kazuo YAMASAKI,Atsushi YAMASHITA,Tomonori KUROKAWA and Sadahiko ISHIBASHI Structure 13C NMR Structure & 13C NMR 碳谱模拟图 35 . dimethyl lithospermate 相似度:51.7% Bioorganic & Medicinal Chemistry 2012 20 4164-4171 Natural products as a gold mine for selective matrix metalloproteinases inhibitors Liyan Wang, Xi Li, Shoude Zhang, Weiqiang Lu, Sha Liao, Xiaofeng Liu, Lei Shan, Xu Shen, Hualiang Jiang, Weidong Zhang, Jin Huang, Honglin Li Structure 13C NMR Structure & 13C NMR 碳谱模拟图 36 . compound 50 C31H28O6 相似度:51.7% European Journal of Organic Chemistry 2010 6760-6778 Syntheses of Macrocyclic Bis(bibenzyl) Compounds Derived from Perrottetin E Andreas Speicher, Matthias Groh, Markus Hennrich and Anh-Minh Huynh Structure 13C NMR Structure & 13C NMR 碳谱模拟图 37 . Gnetin L C29H24O7 相似度:51.7% Journal of Agricultural and Food Chemistry 2009 57 2544-2549 Stilbenoids Isolated from the Seeds of Melinjo (Gnetum gnemon L.) and Their Biological Activity Eishin Kato, Yuji Tokunaga and Fujio Sakan Structure 13C NMR Structure & 13C NMR 碳谱模拟图 38 . 2-((5-(6-(bis(9,9-dimethyl-9H-fluoren-2-yl)amino)-4,4-dimethyl-4H-indeno[1,2-b]thiophen-2-yl)thiophen-2-yl)methylene)malononitrile 相似度:51.7% Tetrahedron 2014 70 6235-6240 Pushepull organic semiconductors with planar indenothiophene bridges for solution-processed small-molecule organic solar cells Jae Kwan Lee, Jooyoung Kim, Hyeju Choi, Kimin Lim, Kihyung Song, Jaejung Ko Structure 13C NMR Structure & 13C NMR 碳谱模拟图 39 . grossamide C36H36N2O8 相似度:51.6% Phytochemistry 2001 58 1219-1223 Lignanamides and other phenolic constituents from the bark of kenaf (Hibiscus cannabinus) Ana M. L. Seca, Artur M. S. Silva, Armando J. D. Silvestre, José. A. S. Cavaleiro,Fernando M. J. Domingues, Carlos Pascoal-Neto Structure 13C NMR Structure & 13C NMR 碳谱模拟图 40 . eriosemaone C C31H30O8 相似度:51.6% Phytochemistry 1995 39 1049-1061 Polyphenols from Eriosema tuberosum Wei Guang Ma, Nicola Fuzzati, Qing Sheng Li, Chong Ren Yang, Helen Stoeckli-Evans, Kurt Hostettmann Structure 13C NMR Structure & 13C NMR 碳谱模拟图 |
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