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tingting1204金虫 (正式写手)
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[求助]
微谱数据求助
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碳谱数据如下,16.6,16.6,29.1,29.1,29.7,33.7,38.4,71.6,74.8,76.7。 十个碳,氘代氯仿做的谱 求解谱啊,谢谢! |
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求助通过微谱查询化合物结构
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[求助]哪位好人学校可以使用微谱数据库,帮我检索几个化合物的母核。谢谢!
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潘宪伟
木虫 (正式写手)
- 应助: 225 (大学生)
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【答案】应助回帖
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感谢参与,应助指数 +1
tingting1204: 金币+15, ★★★★★最佳答案 2013-03-10 11:11:25
感谢参与,应助指数 +1
tingting1204: 金币+15, ★★★★★最佳答案 2013-03-10 11:11:25
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查询结果:共查到128个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 1R,2R,4R-三羟基薄荷烷 C10H20O3 相似度:70% Chinese Pharmaceutical Journal 2003 38 333-335 Study on chemical components of Epimedium leptorrhizum HAN Bing, SHEN Tong, JU Jian hua, YANG Jun shan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . (+) (1R*, 2R*, 4R*)-trihydroxy-p-menth-3-ene C10H20O3 相似度:60% Phytochemistry 2006 67 2103-2109 α-Pinene-type monoterpenes and other constituents from Artemisia suksdorfii Ahmed A. Mahmoud , Ahmed A. Ahmed Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . (4S)-3α,10α,12,15-tetrahydroxycadinane 相似度:60% Phytochemistry 2002 59 479-488 Microbial transformation of cadina-4,10(15)-dien-3-one,aromadendr-1(10)-en-9-one and methyl ursolate by Mucor plumbeus ATCC 4740 Dwight O. Collins, Peter L.D. Ruddock, Jessica Chiverton de Grasse,William F. Reynolds, Paul B. Reese Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . 4α,7β-Dihydroxyeudesmane C15H28O2 相似度:60% Journal of Asian Natural Products Research 2006 8 723-731 Eudesmane-type sesquiterpenoids from the liverwort Lepidozia fauriana H.-S. SHY and C.-L. WU Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . Plenoxide C15H26O2 相似度:60% Journal of Asian Natural Products Research 2005 7 847-852 Chemical constituents from Schisandra plena R.-T. LI, A.-H. ZHAO, Y.-H. SHENG, Z. NA and H.-D. SUN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 7-(methylsulfamyl)heptanenitrile C8H15NS 相似度:60% Phytochemistry 1998 49 1959-1965 Macrocyclic bisbibenzyls in cultured cells of the liverwort, Heteroscyphus planus Kensuke Nabetα, Shinichi Ohkubo, Reiko Hozumi, Kenji Katoh Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . rel-(1S,2R,4R,8S)-p-menthane-1,2,8,9-tetrol C10H20O4 相似度:60% Chemical & Pharmaceutical Bulletin 2002 50 66-72 Water-Soluble Constituents of Caraway: Carvone Derivatives and Their Glucosides Tetsuko Matsumura, Toru Ishikawa and Junichi Kitajima Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 4β-hydroxy-1-menthol 相似度:60% Phytochemistry 1988 27 3861-3869 Preparation of biologically active substances and animal and microbial metabolites from menthols,cineoles and kauranes Yoshinori Asakawa,Reiko Matsuda,Motoo Tori,Toshihiro Hashimoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . 2-exo-hydroxy-1,8-cineole 相似度:60% Phytochemistry 1988 27 3861-3869 Preparation of biologically active substances and animal and microbial metabolites from menthols,cineoles and kauranes Yoshinori Asakawa,Reiko Matsuda,Motoo Tori,Toshihiro Hashimoto Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . Compound h3 相似度:60% Magnetic Resonance in Chemistry 2008 46 1168-1174 Structural elucidation of propargylated products of 3-substituted-1, 2, 4-triazole-5-thiols by NMR techniques (pages 1168–1174) Preeti M. Chaudhary, Sayalee R. Chavan, M. Kavitha, Shailaja P. Maybhate, Sunita R. Deshpande, Anjali P. Likhite and P. R. Rajamohanan Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . (1R,3R)-(3)-1-(2-bromoethyl)-2,2-dimethyl-3-(2-oxopropyl)cyclopropane 相似度:60% Russian Journal of Organic Chemistry 2003 39 75-81 Approaches to Epothilone Carboanalogs Starting from Δ3-Carene F. A. Akbutina, I. F. Sadretdinov, O. M. Kuznetsov, E. V. Vasil'eva and M. S. Miftakhov Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . 1S,2R,4S-trihydroxyl-p-methane 相似度:60% Food Chemistry 2010 118 228-238 Unusual sesquiterpene lactones with a new carbon skeleton and new acetylenes from Ajania przewalskii Ying Zhu, Li-Xia Zhang, Yan Zhao, Guo-Du Huang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . (S)-(+)-diisopropyl (4-bromo-1-mesyloxybutyl)phosphonate C11H24BrO6PS 相似度:60% European Journal of Organic Chemistry 2011 1870-1879 Chemoenzymatic Synthesis of Phosphonic Acid Analogues of L-Lysine, L-Proline, L-Ornithine, and L-Pipecolic Acid of 99 % ee – Assignment of Absolute Configuration to (–)-Proline Frank Wuggenig, Anna Schweifer, Kurt Mereiter and Friedrich Hammerschmidt Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . (3S,4S,6R)-2,7-dimethyl-3,4,6-octanetriol C10H22O3 相似度:60% European Journal of Organic Chemistry 2010 3146-3151 Highly Stereoselective Synthesis of syn-1,3-Diols through a Sequential Titanium-Mediated Aldol Reaction and LiBH4 Reduction Judit Esteve, Sònia Matas, Miquel Pellicena, Javier Velasco, Pedro Romea, Fèlix Urpí and Mercè Font-Bardia Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . 5-(adamant-1-ylmethoxy)pent-2-ene C16H26O 相似度:60% European Journal of Organic Chemistry 2010 1258-1283 Synthesis and Evaluation of Lipophilic Aza-C-glycosides as Inhibitors of Glucosylceramide Metabolism Tom Wennekes, Richard J. B. H. N. van den Berg, Thomas J. Boltje, Wilma E. Donker-Koopman, Bastiaan Kuijper, Gijsbert A. van der Marel, Anneke Strijland, Carlo P. Verhagen, Johannes M. F. G. Aerts and Herman S. Overkleeft Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . compound 9b 相似度:60% Australian Journal of Chemistry 1994 47 1509-1521 2,9-Dihydroxy- and 2,10-Dihydroxy-1,8-cineole. Two New Possum Urinary Metabolites RM Carman, AC Garner and KD Klika Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . (1R,4R,5R,8R)-4,8-dimethyl-2-oxabicyclo[3.3.1]nonan-8-ol C10H18O2 相似度:60% Australian Journal of Chemistry 1995 48 1301-1309 The Synthesis of Two C4 Epimers of 4,8-Dimethyl-2-oxabicyclo[3.3.1]nonan-8-ol (1-Hydroxy-2,9-cineole) RM Carman and AC Garner Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . (1R,2R,4R)-1-methyl-4-(1-methylethyl)-1,2,4-cyclohexanetriol C10H20O3 相似度:60% Bioscience, Biotechnology, and Biochemistry 2012 76 1904-1908 Cleavage of α-Dicarbonyl Compounds by Terpene Hydroperoxide Ryu-ichiro NAGAMATSU, Shinya MITSUHASHI, Kengo SHIGETOMI, Makoto UBUKATA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . (+)-2-endo-hydroxy-1,8-cineole 相似度:60% Journal of Agricultural and Food Chemistry 1989 37 222-226 Hydroxycineole: four new metabolites of 1,8-cineole in rabbits Mitsuo Miyazawa, Hiromu Kameoka, Kunio Morinaga, Kenji Negoro, Nobuo Mura Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . 1β,4β,7α-trihydroxyeudesmane 相似度:60% China Journal of Chinese Materia Medica 2012 37 3430-3433 Chemical constituents of Acorus calamus QIAO Di; GAN Li-she; MO Jian-xia; ZHOU Chang-xin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . 4-pentylcyclohex-3-ene-1α,2β-diol C11H20O2 相似度:54.5% Journal of Asian Natural Products Research 2009 11 805-810 Two new compounds from the roots of Ligusticum chuanxiong Xin-Liang Changa, Zhi-Yong Jianga, Yun-Bao Maa, Xue-Mei Zhanga,Karl W.K. Tsimb and Ji-Jun Chena Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . n-Tritetracontan-5α-ol C43H88O 相似度:54.5% Chinese Journal of Chemistry 2007 25 843-848 New Aliphatic Alcohol and Ester Constituents from Rice Hulls of Oryza sativa ILL-Min Chung, Mohd Ali, Se-Chul Chun, Cheng-Wu Jin, Dong-Ha Cho, Seung-Beom Hong and Ateeque Ahmad Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . (1α,4aβ,8aα)-4a-methyldecahydronaphthalene-1,8a-diol C11H20O2 相似度:54.5% Australian Journal of Chemistry 1981 34 1451-1465 Carbon-13 N.M.R. studies of 5α- and 5β-Cholestan-5-ols and analogous 8a-Methyl-trans- and cis-decahydronaphthalen-4a-ols JM Coxon and JR Gibson Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . (1R,4R,5R,8S,9S,13S)-caryolane-5,8,13-triol C15H26O3 相似度:53.3% Journal of Natural Products 2006 69(10) 1429-1434 Microbial Transformation and Butyrylcholinesterase Inhibitory Activity of (− -Caryophyllene Oxide and Its DerivativesMuhammad Iqbal Choudhary, Zafar A. Siddiqui, Sarfraz A. Nawaz, and Atta-ur-Rahman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . 1β,4β,7α-trihydroxyeudesmane C15H28O3 相似度:53.3% China Journal of Chinese Materia Medica 2003 28 342-344 Studies on the Constituents in Rhizome of Homalomena occuta HU Yongmei, YANG Zhonglin, YE Wencai, CHONG Qihou Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . (E)-7αH-germacra-4,10(14)-diene-1b,6α,11-triol 相似度:53.3% Phytochemistry 1999 51 529-541 Bioactive sesquiterpenes from Santolina rosmarinifolia subsp. Canescens. A conformational analysis of the germacrane ring Alejandro F. Barrero, M. Mar Herrador, Jose F.Quilez, Ramon Alvarez-Manzaneda, Dolores Portal, Jose A. Gavin, Dolores G. Gravalos, M.S.J. Simmonds, W.M. Blaney Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . Prostantherol 相似度:53.3% Phytochemistry 1994 36 957-960 Antimicrobial sesquiterpenes from Prostanthera aff. melissifolia and P. rotundifolia Joanne E. Dillar, Michael D. Cole, Alexander I. Gray, Simon Gibbons, Peter G. Waterman Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . compound 1 C15H26O 相似度:53.3% Phytochemistry 1992 31 2153-2154 A sesquiterpene alcohol from Litsea amara S.A. Achmad, E.L. Ghisalberti, E.H. Hakim, L. Makmur, M. Manurung Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 1β,4β,7β-eudesmanetriol 相似度:53.3% Natural Product Research 2012 26 850-858 A new sesquiterpenoid from the rhizomes of Homalomena sagittifolia K.C. Wong, Abdul Hamid, I.M.S. Eldeen, M. Zaini Asmawi,S. Baharuddin, H.S. Abdillahi and J. Van Staden Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . compound 14 相似度:53.3% Phytochemistry 1989 28 2717-2721 Sesquiterpenoids and phenolics of Pulicaria paludosa Arturo San Feliciano,Manuel Medarde,Marina Gordaliza,Esther Del Olmo,José M. Miguel del Corral Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . (+)-10β,14-dihydroxy-allo-aromadendrane 相似度:53.3% Magnetic Resonance in Chemistry 2003 41 1034-1037 Complete NMR assignment of (+)-10β, 14-dihydroxy-allo-aromadendrane Lucinéia Vizzotto, Rozanna Marques Muzzi and Dênis Pires de Lima Structure 13C NMR 碳谱模拟图 |

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-Caryophyllene Oxide and Its Derivatives