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魔力鸟

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化合物1---13C NMR (101 MHz, CDCl3) δ :61.47,106.91,113.10,114.87,116.65,126.31,132.93,143.14,144.53,146.81,147.83,160.6.

化合物2----13C NMR (101 MHz, CDCl3) δ :
16.23,17.89,23.60,24.38,25.87,26.80,39.88,44.80,116.50,122.60,123.31,124.39,131.65,134.21,136.97,138.85,161.82,208.82.
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wangkaibo123

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感谢参与,应助指数 +1
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558个化合物(查询结果仅供参考)
1 .     8-methoxypsoralen
    相似度:100%
Acta Pharmaceutica Sinica          1993          28          432-436
ISOLATION AND STRUCTURE ELUCIDATION OF QIANHUCOUMARIN A
LY Kong; YH Pei; X Li; TR Zhu and T Okuyama
Structure      13C NMR   碳谱模拟图
2 .     xanthotoxin
    相似度:100%
China Journal of Chinese Materia Medica          2009          34          1231-1234
Coumarins from Peucedanum harry- smithii var. subglabrum
LIWen, FENG Shilan, HU Fangdi, CHEN Erlin
Structure      13C NMR   碳谱模拟图
3 .     xanthotoxin
C12H8O4     相似度:100%
Chemical & Pharmaceutical Bulletin          1999          47          96-100
Antiproliferative Constituents from Umbelliferae Plants. V. A New Furanocoumarin and Falcarindiol Furanocoumarin Ethers from the Root of Angelica japonica
Toshihiro FUJIOKA,Kazuhiro FURUMI,Hiroko FUJII,Hikaru OKABE,Kunihide MIHASHI,Yukitaka NAKANO,Hisashi MATSUNAGA,Mitsuo KATANO and Masato MORI
Structure      13C NMR   碳谱模拟图
4 .     Xanthotoxin
C12H8O4     相似度:100%
Phytochemistry          1998          47          13-16
Psoralen and other linear furanocoumarins as phytoalexins in Glehnia littoralis
Takahiro Masuda, Mitsuo Takasugi, Masaki Anetai
Structure      13C NMR   碳谱模拟图
5 .     xanthotoxin
C12H8O4     相似度:100%
Phytochemistry          1987          26          2063-2069
Chromones and coumarins from Skimmia laureola
E.S. Waight,T.K. Razdan,B. Qadri,S. Harkar
Structure      13C NMR   碳谱模拟图
6 .     xanthotoxin
    相似度:100%
China Journal of Chinese Materia Medica          2010          35          58-62
Chemical constituents of Incarvillea younghusbandii
FU Yu; BAI Yang; DAWA Zhuoma; BAI Bingru; DING Lisheng
Structure      13C NMR   碳谱模拟图
7 .     xanthotoxin
    相似度:100%
Phytochemistry          1979          18          139-143
13 C NMR Chemical shifts and carbon-proton coupling constants of some furocoumarins and furochromones
M. H. A. Elgamal, N. H. Elewa, E. A. M. Elkhrisy, Helmut Duddeck
Structure      13C NMR   碳谱模拟图
8 .     xanthotoxin
C12H8O4     相似度:100%
Phytochemistry          1984          23          419-426
Steroids, chromone and coumarins from angelica officinalis
S. Harkar, T.K. Razdan, E.S. Waight
Structure      13C NMR   碳谱模拟图
9 .     Xanthotoxin
    相似度:100%
Archives of Pharmacal Research          2002          25          824-830
Constituents of the fruits and leaves of Euodia daniellii
Sang Woo Yoo, Ju Sun Kim, Sam Sik Kang, Kun Ho Son and Hyeun Wook Chang, et al.
Structure      13C NMR   碳谱模拟图
10 .     Xanthotoxin
    相似度:100%
Archives of Pharmacal Research          2004          27          1211-1215
Cytotoxic coumarins from the root of Angelica dahurica
Pham Ngoc Thanh, WenYi Jin, GyuYong Song, KiHwan Bae and Sam Sik Kang
Structure      13C NMR   碳谱模拟图
11 .     Xanthotoxin
    相似度:100%
Archives of Pharmacal Research          2006          29          617-623
Chemical constituents of the root of Dystaenia takeshimana and their anti-inflammatory activity
Ju Sun Kim, Jin Cheul Kim, Sang Hee Shim, Eun Ju Lee and Wen Yi Jin, et al.
Structure      13C NMR   碳谱模拟图
12 .     xanthotoxin
    相似度:100%
Bioscience, Biotechnology, and Biochemistry          2000          64          420-423
Coumarin-related Compounds as Plant Growth Inhibitors from Two Rutaceous Plants in Thailand
Suratwadee JIWAJINDA, Vilai SANTISOPASRI, Hajime OHIGASHI
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
2楼2013-07-22 21:47:43
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wangkaibo123

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kerry

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【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
魔力鸟: 金币+15 2013-07-22 23:11:28
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669个化合物(查询结果仅供参考)
1 .     mutisiphenone A
C19H26O2     相似度:94.7%
Zeitschrift für Naturforschung C          2003          58          533-540
Antifungal Methylphenone Derivatives and 5-Methylcoumarins from Mutisia friesiana
C. I. Viturro, J. R. de la Fuente, and M. S. Maier
Structure      13C NMR   碳谱模拟图
2 .     3-(3,7-dimethylocta-2,6-diemyl)-4-hydroxy-2H-chromeme-2-thiome (depremyl thioferulemol)
C19H22O2S     相似度:68.4%
Journal of Heterocyclic Chemistry          2007          44          411-418
Cyclization reactions of coumarin derivatives: Chemo-and regioselectivity effects of oxygen/sulfur isosteric replacement
Giovanni Palmisano,Lucio Toma,Rita Annunziata,Silvia Tagliapietra,Alessandro Barge and Giancarlo Cravotto
Structure      13C NMR   碳谱模拟图
3 .     compound 1
C36H53O5SNa     相似度:68.4%
Experientia          1987          43          1233-1234
Isolation of a hexaprenylhydroquinone sulfate from the marine spongeDysidea sp. as an H, K-ATPase inhibitor
N. Fusetani, M. Sugano, S. Matsunaga, K. Hashimoto and H. Shikama, et al.
Structure      13C NMR   碳谱模拟图
4 .     compound 9
    相似度:66.6%
Phytochemistry          1993          34          1603-1607
Sapelenins A, B and C, acyclic triterpenoids from the stem bark of Entandrophragma cylindricum
David Ngnokam, Georges Massiot, Jean-Marc Nuzillard, Joseph D. Connolly, Etienne Tsamo, Christophe Morin
Structure      13C NMR   碳谱模拟图
5 .     Sesquilavandulal
C15H25O     相似度:66.6%
Phytochemistry          2010          71          1545-1557
Irregular sesquiterpenoids from Ligusticum grayi roots
Laurence G. Cool, Karl E. Vermillion, Gary R. Takeoka, Rosalind Y. Wong
Structure      13C NMR   碳谱模拟图
6 .     agelasidine-A
C18H33N3O2     相似度:66.6%
Tetrahedron letters          1983          24          4105-4108
Agelasidine-A, a novel sesquiterpene possessing antispasmodic activity from the okinawa sea sponge Agelas sp.
Hideshi Nakamura, Houming Wu, Jun'ichi Kobayashi, Yasushi Ohizumi, Yoshimasa Hirata, Tsutomu Higashijima, Tatsuo Miyazawa
Structure      13C NMR   碳谱模拟图
7 .     Dimethyl [4,8,12-trimethyl-(E,E)-3,7,11-tridecatrienyl]phosphonate
C18H34O3P     相似度:66.6%
Bioorganic & Medicinal Chemistry          1998          6          687-694
Phosphonate and bisphosphonate analogues of farnesyl pyrophosphate as potential inhibitors of farnesyl protein transferase
Sarah A Holstein, Diana M Cermak, David F Wiemer, Kriste Lewis, Raymond J Hohl
Structure      13C NMR   碳谱模拟图
8 .     (E,E)-5,9,13-Trimethyl-4,8,12-tetradecatrienoic acid
    相似度:66.6%
Bioorganic & Medicinal Chemistry          2000          8          2729-2737
2-(Acyloxy)ethylphosphonate analogues of prenyl pyrophosphates: synthesis and biological characterization
Diana M. Cermak, David F. Wiemer, Kriste Lewis, Raymond J. Hohl
Structure      13C NMR   碳谱模拟图
9 .     Geranyllinaloisocyanide
C21H33N     相似度:66.6%
Journal of the Chemical Society, Perkin Transactions 1          1993                   2429-2432
Novel, regioselective allylamine construction; first synthesis of geranyllinaloisocyanide, a diterpene from the marine sponge, Halichondria sp.
Yoshiyasu Ichikawa, Masatugu Yamazaki and Minoru Isobe
Structure      13C NMR   碳谱模拟图
10 .     (4E,8E)-5,9,13-Trimethyltetradeca-4,8,12-trien-1-al
C17H28O     相似度:66.6%
Journal of the Chemical Society, Perkin Transactions 1          1999                   489-496
Synthesis of rac-hippospongic acid A and revision of the structure
Munetaka Tokumasu, Hiroshi Ando, Yoshikazu Hiraga, Satoshi Kojima and Katsuo Ohkata
Structure      13C NMR   碳谱模拟图
11 .     Agelasidine A
C18H33N3O2S     相似度:66.6%
Journal of the American Chemical Society          1984          106          1819-1822
Antimicrobial metabolites from a Pacific sponge, Agelas sp
Robert J. Capon, D. John Faulkner
Structure      13C NMR   碳谱模拟图
12 .     (5E,9E)-6,10,14-Trimethylpentadeca-5,9,13-trien-2-one
C18H30O     相似度:66.6%
Australian Journal of Chemistry          1982          35          171-182
C18 terpenoid metabolites of the brown alga Cystophora moniliformis
BN Ravi, PT Murphy, RO Lidgard, RG Warren and RJ Wells
Structure      13C NMR   碳谱模拟图
13 .     Yalongene B
C20H30     相似度:65%
Helvetica Chimica Acta          2012          95          235-239
YalongenesA and B, Two New Cembranoids with Cytoprotective Effects from the Hainan Soft Coral Sarcophyton trocheliophorum Marenzeller
Li-Gong Yao, Hai-Yan Zhang, Lin-Fu Liang, Xian-Jun Guo, Shui-Chun Mao, and Yue-Wei Guo
Structure      13C NMR   碳谱模拟图
14 .     2-(Dimethoxyphosphinyl)ethyl (E,E)-5,9,13-trimethyl-4,8,12-tetradecatrienoate
C21H37O5P     相似度:65%
Bioorganic & Medicinal Chemistry          2000          8          2729-2737
2-(Acyloxy)ethylphosphonate analogues of prenyl pyrophosphates: synthesis and biological characterization
Diana M. Cermak, David F. Wiemer, Kriste Lewis, Raymond J. Hohl
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
3楼2013-07-22 21:48:55
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