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lcyscau

木虫 (正式写手)

[求助] 微谱数据求助

碳谱数据如下,溶剂是氘代氯仿,谢谢啦!
15.3,20.9,21.2,27.4,34.5,39.6,46.8,48.6,52.9,61.3,73.2,128.7,147.7,169.3,172.5
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wangkaibo123

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【答案】应助回帖

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感谢参与,应助指数 +1
lcyscau: 金币+20, ★★★★★最佳答案 2013-11-02 13:29:11
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151个化合物(查询结果仅供参考)
1 .     heptelidic acid chlorohydrin
C15H21O5Cl     相似度:100%
The Journal of Antibiotics          1994          47          1562-1563
ANTITUMOR ACTIVITY OF HEPTELIDIC ACID CHLOROHYDRIN
JUN KAWASHIMA, FUMI ITO, TAKASHI KATO, MITSURU NIWANO, HIROYUKI KOSHINO, MASAKAZU URAMOTO
Structure      13C NMR   碳谱模拟图
2 .     trichoderonic acid A
C16H24O6     相似度:81.2%
Bioscience, Biotechnology, and Biochemistry          2010          74          793-801
Novel Terpenoids, Trichoderonic Acids A and B Isolated from Trichoderma virens, Are Selective Inhibitors of Family X DNA Polymerases
Yasuhiro YAMAGUCHI, Daisuke MANITA, Toshifumi TAKEUCHI, Kouji KURAMOCHI, Isoko KURIYAMA, Fumio SUGAWARA, Hiromi YOSHIDA and Yoshiyuki MIZUSHINA
Structure      13C NMR   碳谱模拟图
3 .     (4S)-10α,15-epoxy-12-hydroxycadinan-3-one
C15H24O3     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 .     compound 53
C15H22O     相似度:60%
Canadian Journal of Chemistry          2006          84          1456-1469
Intramolecular [4 + 3] cycloadditions -Stereochemical issues in the cycloaddition reactions of cyclopentenyl cations - A synthesis of (+)-dactylol1
Michael Harmata, Paitoon Rashatasakhon, and Charles L. Barnes
Structure      13C NMR   碳谱模拟图
5 .     laricinolic acid
C15H24O3     相似度:60%
Journal of the Chemical Society, Perkin Transactions 1          2000                   2307-2309
The structure of laricinolic acid and its biomimetic transformation into officinalic acid
Bernhard Erb, Hans-Jürg Borschberg and Duilio Arigoni
Structure      13C NMR   碳谱模拟图
6 .     (+)-Heptelidic acid
C15H20O5     相似度:60%
Bioscience, Biotechnology, and Biochemistry          2010          74          793-801
Novel Terpenoids, Trichoderonic Acids A and B Isolated from Trichoderma virens, Are Selective Inhibitors of Family X DNA Polymerases
Yasuhiro YAMAGUCHI, Daisuke MANITA, Toshifumi TAKEUCHI, Kouji KURAMOCHI, Isoko KURIYAMA, Fumio SUGAWARA, Hiromi YOSHIDA and Yoshiyuki MIZUSHINA
Structure      13C NMR   碳谱模拟图
7 .     laricinolicacid
C15H24O3     相似度:60%
Natural Product Research and Development          2011          23          267-269
Chemical Constituents of Loropetalum chinense
Chemical Constituents of Loropetalum chinense
Structure      13C NMR   碳谱模拟图
8 .     4ξ-chloro-cadin-11-ene
C15H25Cl     相似度:60%
Tetrahedron          1999          55          15099-15108
Synthesis of amorphane and cadinane sesquiterpenes from fabiana imbricata
Koon-Sin Ngo, Geoffrey D. Brown
Structure      13C NMR   碳谱模拟图
9 .     methyl (1R*,5R*,6R*,9R*)-5,9-dimethyl-2-oxo-3-oxabicyclo[4.3.0]nona-7-ene-1-carboxylate
C12H16O4     相似度:60%
Tetrahedron          2011          67          9909-9921
Scope and applications of second generation palladium-catalyzed cycloalkenylation. Stereoselective total syntheses of isoiridomyrmecin, isodihydronepetalactone, and α-skytanthine
Kazutaka Takeda, Masahiro Toyota
Structure      13C NMR   碳谱模拟图
10 .     (+)-vittatalactone
C16H30O2     相似度:60%
European Journal of Organic Chemistry          2011                   4603-4608
Enantioselective Total Synthesis of (+)-Vittatalactone
Jhillu S. Yadav, Nagendra Nath Yadav, T. Srinivasa Rao, B. V. Subba Reddy and Ahmad Al Khazim Al Ghamdi
Structure      13C NMR   碳谱模拟图
11 .     cyclo(-Aho(t-Bu)-Ser(t-Bu)-Aho(t-Bu)-Ser(t-Bu)-Aho(t-Bu)-Ser(t-Bu)-)
C54H99N9O15     相似度:60%
Bioorganic & Medicinal Chemistry          2013          21          4296-4300
Synthesis and functional analysis of deferriferrichrysin derivatives: Application to colorimetric pH indicators
Yuka Kobayashi, Shinya Oishi, Kazuya Kobayashi, Hiroaki Ohno, Hiroko Tsutsumi, Yoji Hata, Nobutaka Fujii
Structure      13C NMR   碳谱模拟图
12 .     vittatalactone
C16H30O2     相似度:56.2%
Journal of Natural Products          2005          68          26-30
Vittatalactone, a β-Lactone from the Striped Cucumber Beetle, Acalymma vittatum
Bruce D. Morris, Rebecca R. Smyth, Stephen P. Foster, Michael P.Hoffmann, Wendell L. Roelofs, Stephan Franke, and Wittko Francke
Structure      13C NMR   碳谱模拟图
13 .     10-Dehydroxydihydrobotridialone
C17H26O5     相似度:56.2%
Phytochemistry          1996          41          513-517
Biologically active sesquiterpenoid metabolites from the fungus Botrytis cinerea
Isidro G. Collado, Rosario Hernández-Galán, Victoria Prieto, James R. Hanson, Laureana G. Rebordinos
Structure      13C NMR   碳谱模拟图
14 .     xylaric acid B
C16H26O7     相似度:56.2%
Chemistry & Biodiversity          2011          Vol. 8          1689-1700
Terpenoid and Phenolic Metabolites from the Fungus Xylaria sp. Associated with Termite Nests
Sha Yan, Saifei Li, Wen Wu, Feng Zhao, Li Bao, Rong Ding, Hao Gao, Hua-An Wen, Fuhang Song, and Hong-Wei Liu
Structure      13C NMR   碳谱模拟图
15 .     compound 10
C18H29NO8     相似度:56.2%
Tetrahedron Letters          2004          45          5007-5009
Stereoselective routes to 3-hydroxy and 3,4-dihydroxy derivatives of 2-aminocyclohexanecarboxylic acid
Ishmael B. Masesane, Patrick G. Steel
Structure      13C NMR   碳谱模拟图
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