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zhangli1987铁虫 (小有名气)
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[求助]
微谱求助化合物结构
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| 14.2,26.8,29.7,50.9,68.9,72.3,103.5,111.2,122.4,124.9，128.3,132.8,157.4,162.1,197.7 |
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wangkaibo123
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【答案】应助回帖
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查询模式：模糊查询 碳谱数据输入： 按从小到大顺序输入，数字间用英文半角逗号(,)分隔例如： 21.4,30.4,37.4,73.2,73.7,125.6,126.6,139.6,140.2,168.2 溶剂选项： 匹配容差： (数字格式，可自行设定) 相似度： %(相似度>=50%) 查询结果：共查到44个化合物(查询结果仅供参考) 1 . 5-acetyl-2-(2-[1,2-dihydroxyisopropyl)]-benzofuran 相似度:80% Phytochemistry 1997 46 1077-1080 Benzofurans, benzofuran dimers and other constituents from Ophryosporus charua Marina E. P. de Lampasona, César A. N. Catalán, Thomas E. Gedris, Werner Herz Structure 13C NMR 碳谱模拟图 2 . 5-acetyl-2-(1-hydroxy-1-methylethyl)benzofuran C13H14O3 相似度:66.6% Phytochemistry 1996 43 1019-1021 Three 4′-hydroxyacetophenone-related phytoalexins from Polymnia sonchifolia Mitsuo Takasugi, Takahiro Masuda Structure 13C NMR 碳谱模拟图 3 . Matriisobenzofuran C13H14O3 相似度:66.6% Phytochemistry Letters 2010 3 207-211 Glutathione S-transferase inhibitory, free radical scavenging, and anti-leishmanial activities of chemical constituents of Artocarpus nobilis and Matricaria chamomilla Chad D. Iverson, Shamsulhaq Zahid, Yimeng Li, Ahmed H. Shoqafi, Athar Ata, Radhika Samarasekera Structure 13C NMR 碳谱模拟图 4 . 6-Acetyl-3-hydroxy-2α-methylchromene C12H12O3 相似度:60% Natural Product Communications 2008 3 799-803 New Derivatives of Chromene and AcetoxyeudesmaneObtained by Microbial Transformation Mamdouh S. A. Haridy and Abou El-Hamd H. Mohamed Structure 13C NMR 碳谱模拟图 5 . 3-(2-benzofuranyl)quinuclidin-3-ol methiodide C16H20INO2 相似度:56.2% Journal of Medicinal Chemistry 1995 38 473-487 3-Heteroaryl-Substituted Quinuclidin-3-ol and Quinuclidin-2-ene Derivatives as Muscarinic Antagonists. Synthesis and Structure-Activity Relationships Bjoern M. Nilsson, Staffan Sundquist, Gary Johansson, Gunnar Nordvall, Gunilla Glas, Lisbeth Nilvebrant, Uli Hacksell Structure 13C NMR 碳谱模拟图 6 . 6-(4-Acetoxy-3-methyl-2-butenyl)-7-hydroxycoumarin C16H16O5 相似度:56.2% Phytochemistry 2012 75 108-113 Alkaloid and coumarins from the green fruits of Aegle marmelos Suda Chakthong, Paosiyah Weaaryee, Pongsak Puangphet, Wilawan Mahabusarakam, Patimaporn Plodpai, Supayang P. Voravuthikunchai, Akkharawit Kanjana-Opas Structure 13C NMR 碳谱模拟图 7 . dehydrotremetone 相似度:53.3% Journal of Natural Products 1979 Vol 42 203-219 The Benzofurans of Isocoma wrightii. Structure and Stereochemistry L. H. Zalkow, B. A. Ekpo, L. T. Gelbaum, R. N. Harris III., E. Keinan, J. R. Novak Jr., C. T. Ramming, D. Van Derveer Structure 13C NMR 碳谱模拟图 8 . 5-(Indol-3-yl)-pent-(3E)-en-2-one C13H13NO 相似度:53.3% Journal of Natural Products 1991 Vol 54 1056 Aromatic Secondary Metabolites from the Sponge Tedania ignis Rhonda L. Dillman, John H. Cardellina II. Structure 13C NMR 碳谱模拟图 9 . 2-[(S)-1-(Methoxycarbonyl)-3-methylthiopropyl]-3-oxo-2,3-dihydrobenzo[d][1,2]thiazol 1,1-dioxide C13H15NO5S2 相似度:53.3% Pharmazie 2002 57 384-392 Synthesis and properties of N-substituted saccharin derivatives L. Soubh - A. Besch - H.-H. Otto Structure 13C NMR 碳谱模拟图 10 . 2-[4-Chloro-6-(2,3-dimethyl-phenylamino)-pyrimidin-2-ylsulfanyl]-2-methyl-propionic acid C16H18ClN3O2S 相似度:53.3% Archiv der Pharmazie 2008 341 191-195 α-Alkyl Substituted Pirinixic Acid Derivatives as Potent Dual Agonists of the Peroxisome Proliferator Activated Receptor Alpha and Gamma Oliver Rau, Yvonne Syha, Heiko Zettl, Michael Kock, Andreas Bock and Manfred Schubert-Zsilavecz Structure 13C NMR 碳谱模拟图 11 . 12-(Trimethylsilyl)-1,10-dioxa[10]paracyclophane C17H28O2Si 相似度:53.3% Tetrahedron 2012 68 1407-1416 Asymmetric ortho-lithiation of 1,n-dioxa[n]paracyclophane derivatives for the generation of planar chirality Kazumasa Kanda, Risa Hamanaka, Kohei Endo, Takanori Shibata Structure 13C NMR 碳谱模拟图 12 . 1-Bromo-2-octyloxybenzene C14H21BrO 相似度:53.3% Tetrahedron 2012 68 4286-4291 N-(2-Alkoxyphenyl)-substituted double rhodanine indoline dyes for zinc oxide dye-sensitized solar cell Masaki Matsui, Takahiro Shiota, Yasuhiro Kubota, Kazumasa Funabiki, Jiye Jin, Tsukasa Yoshida, Shinji Higashijima, Hidetoshi Miura Structure 13C NMR 碳谱模拟图 13 . 2-hexamethyleneiminomethylene-3(2H)-benzofuranone C15H17NO2 相似度:53.3% Heterocycles 2001 55 881-888 Reaction of 3-Iodochromone with Nucleophiles 3. Formation of 2-Aminomethylene-3(2H)-benzofuranones by the Reaction with Secondary Amines Yoshiaki Sugita,* Takako Iwaki, Misaki Okamoto, and Ichiro Yokoe Structure 13C NMR 碳谱模拟图 14 . 2-diethylaminomethylene-3(2H)-benzofuranone C13H15NO2 相似度:53.3% Heterocycles 2001 55 881-888 Reaction of 3-Iodochromone with Nucleophiles 3. Formation of 2-Aminomethylene-3(2H)-benzofuranones by the Reaction with Secondary Amines Yoshiaki Sugita,* Takako Iwaki, Misaki Okamoto, and Ichiro Yokoe Structure 13C NMR 碳谱模拟图 15 . compound 10 相似度:53.3% Tetrahedron 1991 47 9411-9418 New examples of acyclic and cyclic C-15 acetogenins from laurencia pinnatifida. Reassignment of the absolute configuration for E and Z pinnatifidienyne. Manuel Noite, Antonio G. Gonzalez, Fernando Cataldo, Matías L. Rodríguez, Ivan Brito Structure 13C NMR 碳谱模拟图 |
2楼2013-12-03 17:37:20
有所不为
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【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
zhangli1987: 金币+8 2013-12-04 10:56:58
感谢参与，应助指数 +1
zhangli1987: 金币+8 2013-12-04 10:56:58
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查询结果：共查到44个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 5-acetyl-2-(2-[1,2-dihydroxyisopropyl)]-benzofuran 相似度:80% Phytochemistry 1997 46 1077-1080 Benzofurans, benzofuran dimers and other constituents from Ophryosporus charua Marina E. P. de Lampasona, César A. N. Catalán, Thomas E. Gedris, Werner Herz Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 5-acetyl-2-(1-hydroxy-1-methylethyl)benzofuran C13H14O3 相似度:66.6% Phytochemistry 1996 43 1019-1021 Three 4′-hydroxyacetophenone-related phytoalexins from Polymnia sonchifolia Mitsuo Takasugi, Takahiro Masuda Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . Matriisobenzofuran C13H14O3 相似度:66.6% Phytochemistry Letters 2010 3 207-211 Glutathione S-transferase inhibitory, free radical scavenging, and anti-leishmanial activities of chemical constituents of Artocarpus nobilis and Matricaria chamomilla Chad D. Iverson, Shamsulhaq Zahid, Yimeng Li, Ahmed H. Shoqafi, Athar Ata, Radhika Samarasekera Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 6-Acetyl-3-hydroxy-2α-methylchromene C12H12O3 相似度:60% Natural Product Communications 2008 3 799-803 New Derivatives of Chromene and AcetoxyeudesmaneObtained by Microbial Transformation Mamdouh S. A. Haridy and Abou El-Hamd H. Mohamed Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . 3-(2-benzofuranyl)quinuclidin-3-ol methiodide C16H20INO2 相似度:56.2% Journal of Medicinal Chemistry 1995 38 473-487 3-Heteroaryl-Substituted Quinuclidin-3-ol and Quinuclidin-2-ene Derivatives as Muscarinic Antagonists. Synthesis and Structure-Activity Relationships Bjoern M. Nilsson, Staffan Sundquist, Gary Johansson, Gunnar Nordvall, Gunilla Glas, Lisbeth Nilvebrant, Uli Hacksell Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 6-(4-Acetoxy-3-methyl-2-butenyl)-7-hydroxycoumarin C16H16O5 相似度:56.2% Phytochemistry 2012 75 108-113 Alkaloid and coumarins from the green fruits of Aegle marmelos Suda Chakthong, Paosiyah Weaaryee, Pongsak Puangphet, Wilawan Mahabusarakam, Patimaporn Plodpai, Supayang P. Voravuthikunchai, Akkharawit Kanjana-Opas Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . dehydrotremetone 相似度:53.3% Journal of Natural Products 1979 Vol 42 203-219 The Benzofurans of Isocoma wrightii. Structure and Stereochemistry L. H. Zalkow, B. A. Ekpo, L. T. Gelbaum, R. N. Harris III., E. Keinan, J. R. Novak Jr., C. T. Ramming, D. Van Derveer Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 5-(Indol-3-yl)-pent-(3E)-en-2-one C13H13NO 相似度:53.3% Journal of Natural Products 1991 Vol 54 1056 Aromatic Secondary Metabolites from the Sponge Tedania ignis Rhonda L. Dillman, John H. Cardellina II. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 2-[(S)-1-(Methoxycarbonyl)-3-methylthiopropyl]-3-oxo-2,3-dihydrobenzo[d][1,2]thiazol 1,1-dioxide C13H15NO5S2 相似度:53.3% Pharmazie 2002 57 384-392 Synthesis and properties of N-substituted saccharin derivatives L. Soubh - A. Besch - H.-H. Otto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 2-[4-Chloro-6-(2,3-dimethyl-phenylamino)-pyrimidin-2-ylsulfanyl]-2-methyl-propionic acid C16H18ClN3O2S 相似度:53.3% Archiv der Pharmazie 2008 341 191-195 α-Alkyl Substituted Pirinixic Acid Derivatives as Potent Dual Agonists of the Peroxisome Proliferator Activated Receptor Alpha and Gamma Oliver Rau, Yvonne Syha, Heiko Zettl, Michael Kock, Andreas Bock and Manfred Schubert-Zsilavecz Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 12-(Trimethylsilyl)-1,10-dioxa[10]paracyclophane C17H28O2Si 相似度:53.3% Tetrahedron 2012 68 1407-1416 Asymmetric ortho-lithiation of 1,n-dioxa[n]paracyclophane derivatives for the generation of planar chirality Kazumasa Kanda, Risa Hamanaka, Kohei Endo, Takanori Shibata Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 1-Bromo-2-octyloxybenzene C14H21BrO 相似度:53.3% Tetrahedron 2012 68 4286-4291 N-(2-Alkoxyphenyl)-substituted double rhodanine indoline dyes for zinc oxide dye-sensitized solar cell Masaki Matsui, Takahiro Shiota, Yasuhiro Kubota, Kazumasa Funabiki, Jiye Jin, Tsukasa Yoshida, Shinji Higashijima, Hidetoshi Miura Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . 2-hexamethyleneiminomethylene-3(2H)-benzofuranone C15H17NO2 相似度:53.3% Heterocycles 2001 55 881-888 Reaction of 3-Iodochromone with Nucleophiles 3. Formation of 2-Aminomethylene-3(2H)-benzofuranones by the Reaction with Secondary Amines Yoshiaki Sugita,* Takako Iwaki, Misaki Okamoto, and Ichiro Yokoe Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . 2-diethylaminomethylene-3(2H)-benzofuranone C13H15NO2 相似度:53.3% Heterocycles 2001 55 881-888 Reaction of 3-Iodochromone with Nucleophiles 3. Formation of 2-Aminomethylene-3(2H)-benzofuranones by the Reaction with Secondary Amines Yoshiaki Sugita,* Takako Iwaki, Misaki Okamoto, and Ichiro Yokoe Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . compound 10 相似度:53.3% Tetrahedron 1991 47 9411-9418 New examples of acyclic and cyclic C-15 acetogenins from laurencia pinnatifida. Reassignment of the absolute configuration for E and Z pinnatifidienyne. Manuel Noite, Antonio G. Gonzalez, Fernando Cataldo, Matías L. Rodríguez, Ivan Brito Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . methyl 5-(4-chlorophenyl)-2,2-dimethyl-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxol-4-ylcarbamate C17H20O4NCl 相似度:53.3% Heterocycles 2012 86 1055-1069 Advances in Siloxane-Based Coupling Reactions: Application of Palladium-Mediated Allyl-Aryl Coupling to the Synthesis of Pancratistatin Derivatives. The Formal Total Synthesis of (±)-7-Deoxypancratistatin Krupa H. Shukla and Philip DeShong Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . 4-amino-2-(2,4-difluorophenyl)phthalazin-1(2H)-one C14H9F2N3O 相似度:53.3% Tetrahedron 2013 69 395-409 Facile synthesis of novel 7-aminofuro- and 7-aminothieno[2,3-d]pyridazin-4(5H)-one and 4-aminophthalazin-1(2H)-ones Gani Koza, Selbi Keskin, Merve Sinem Özer, Betül Cengiz, Ertan Şahin, Metin Balci Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . ethyl 5-amino-4-cyano-2-(3-nitrophenyl)-1H-pyrrole-3-carboxylate C14H12N4O4 相似度:53.3% Tetrahedron 2013 69 1953-1957 Facile, eco-friendly, catalyst-free synthesis of polyfunctionalized 2-aminopyrroles Wanwan Yu, Wenteng Chen, Shen Liu, Jiaan Shao, Zhanying Shao, Haili Lin, Yongping Yu Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . 4-(5-(Ethoxycarbonyl)-3-methyl-1H-indole-2-carboxamido) butan-1-aminium 2,2,2-trifluoroacetate 相似度:53.3% Bioorganic & Medicinal Chemistry 2011 19 4346-4354 Synthesis and evaluation of bidentate ligands designed to interact with PDZ domains Benjamin Boucherle, Alexandre Vogrig, Hemantkumar Deokar, Naoual Bouzidi, Isabelle Ripoche, Isabelle Thomas, Philippe Marin, Sylvie Ducki Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . Meridoquin C16H17ClN4 相似度:53.3% Bioorganic & Medicinal Chemistry 2011 19 5756-5762 CNS and antimalarial activity of synthetic meridianin and psammopemmin analogs Matthew D. Lebar, Kristopher N. Hahn, Tina Mutka, Patrick Maignan, James B. McClintock, Charles D. Amsler, Alberto van Olphen, Dennis E. Kyle, Bill J. Baker Structure 13C NMR 碳谱模拟图 |
3楼2013-12-03 17:38:36