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icaszzx

木虫 (正式写手)

[求助] 求助微谱数据

CDCl3
15.6,17.5,18.1,19.3,20.9,24.2,24.8,24.9,28.7,29.7,36.8,37.3,75.8,77.4,79.4,83.5,85.1,128.4,129.6,129.9,133.3,133.4,136.4,137.9,147.4,167.1,171.9

[ Last edited by icaszzx on 2013-6-5 at 17:18 ]
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wangwang1989

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【答案】应助回帖

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icaszzx: 金币+10, ★★★很有帮助 2013-06-05 22:25:53
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175个化合物(查询结果仅供参考)
1 .     4-O-acetyl-5-O-benzoyl-3β-hydroxy-20-deoxyingenol
C29H36O6     相似度:62.9%
Journal of Asian Natural Products Research          2008          10          101-104
A new diterpene from the processed roots of Euphorbia Kansui
CHUN-FA LI, JIN-HUI WANG, YUE CONG and XIAN LI
Structure      13C NMR   碳谱模拟图
2 .     kansuiphorin C
C29H34O6     相似度:60.7%
Chinese Traditional and Herbal Drugs          2003          34          489-492
Studies on ingenol-type diterpene esters in root tuber of Euphorbia kansui
PAN Qin; MIN Zhi-da
Structure      13C NMR   碳谱模拟图
3 .     (3RS,6E,8E)-and (3RS,6E,8Z)-3,7-Dimethylundeca-6,8-dienyl-1-acetate
    相似度:59.2%
Journal of the Brazilian Chemical Society          2000          11          572-577
Synthesis of the Minor Sex Pheromone Component of Two Brazilian Soybean Stink Bugs (Het: Pentatomidae), and an Analogue Compound.
Paulo H. G. Zarbin, Aurélia Reckziegel, Ernst Plass, Alfredo R. M. de Oliveira, Fábio Simonelli and Francisco de A. Marques
Structure      13C NMR   碳谱模拟图
4 .     kansuiphorin D
C27H30O4     相似度:59.2%
Chinese Traditional and Herbal Drugs          2012          43          1891-1895
Study on antitumor constituents of Euphorbia lunulata
WANG Jue; LI Xiao-fan; XIE Pu; WANG Tie-jie
Structure      13C NMR   碳谱模拟图
5 .     29-nor-lanost-8,24-dien-1α,2α,3β-triol
C29H48O3     相似度:58.6%
Phytochemistry          1988          27          3841-3843
Major triterpenes from the resins of Commiphora incisa and C. kua and their potential chemotaxonomic significance
Gordon J. provan,Peter G. Waterman
Structure      13C NMR   碳谱模拟图
6 .     compound 9b
C33H40O12     相似度:58.0%
Bioorganic & Medicinal Chemistry          2010          18          5634-5646
Elucidation of the topography of the thapsigargin binding site in the sarco-endoplasmic calcium ATPase
Dorthe Mondrup Skytte, Jesper Vuust Møller, Huizhen Liu, Helle Østergren Nielsen, Louise Elsa Svenningsen, Christina Mernøe Jensen, Carl Erik Olsen, Søren Brøgger Christensen
Structure      13C NMR   碳谱模拟图
7 .     19-nor-24-oxoergosta-5,7,9-trien-3β-yl Acetate
C28H40O3     相似度:57.1%
Journal of Natural Products          1998          61          1491-1496
Phycomysterols and Other Sterols from the Fungus Phycomyces blakesleeanus
Alejandro F. Barrero, J. Enrique Oltra, Juan A. Poyatos, David Jiménez, and Eulalia Oliver
Structure      13C NMR   碳谱模拟图
8 .     scuterivulactone C1
C29H38O9     相似度:57.1%
Chemical & Pharmaceutical Bulletin          1997          45          152-160
Studies on the Constituents of Scutellaria Species. XVIII. Structures of Neoclerodane-Type Diterpenoids from the Whole Herb of Scutellaria rivularis WALL.
Haruhisa KIZU,Yoshitaka IMOTO,Tsuyoshi TOMIMORI,Tohru KIKUCHI,Shigetoshi KADOTA and Koji TSUBONO
Structure      13C NMR   碳谱模拟图
9 .     17-hydroxyingenol 17-benzoate 20-angelate
    相似度:56.6%
Phytochemistry          1997          45          563-570
Ingenane and lathyrane diterpenes from the latex of Euphorbia canariensis
J. Alberto Marco, Juan F. Sanz-Cervera, Alberto Yuste
Structure      13C NMR   碳谱模拟图
10 .     trijugin D
C27H42O8     相似度:55.5%
Journal of Natural Products          2010          73          1146-1150
Terpenoids from Salvia trijuga
Zheng-Hong Pan, Yuan-Yuan Wang, Ming-Ming Li, Gang Xu, Li-Yan Peng, Juan He, Yu Zhao, Yan Li and Qin-Shi Zhao
Structure      13C NMR   碳谱模拟图
11 .     trijugin F
C27H42O8     相似度:55.5%
Journal of Natural Products          2010          73          1146-1150
Terpenoids from Salvia trijuga
Zheng-Hong Pan, Yuan-Yuan Wang, Ming-Ming Li, Gang Xu, Li-Yan Peng, Juan He, Yu Zhao, Yan Li and Qin-Shi Zhao
Structure      13C NMR   碳谱模拟图
12 .     7,13-dideacetyl-9,10-debenzoyltaxchinin C
C29H38O10     相似度:55.5%
Journal of Natural Products          1994          Vol 57          1017
Isolation and Structure Elucidation of New Taxoids from Taxus brevifolia
Ru Chen, David G. I. Kingston
Structure      13C NMR   碳谱模拟图
13 .     3-O-benzoyl-hosloquinone
C27H28O4     相似度:55.5%
Phytochemistry          1992          31          3781-3784
Antimalarial compounds from Hoslundia opposita
Hans Achenbach, Reiner Waibel, Mayunga H.H. Nkunya, Hugo Weenen
Structure      13C NMR   碳谱模拟图
14 .     Crassumol C
C22H34O4     相似度:55.5%
Marine drugs          2011          9          2705-2716
Cembranoids from the Dongsha Atoll Soft Coral Lobophytum crassum
Shih-Tseng Lin,Shang-Kwei Wang and Chang-Yih Duh
Structure      13C NMR   碳谱模拟图
15 .     compound 14
C27H37NO5S2     相似度:55.5%
Heterocycles          2009          77          279-291
Benzothiazines in Organic Synthesis. An Approach to the Synthesis of seco-Pseudopteroxazole
Michael Harmata and Pinguan Zheng
Structure      13C NMR   碳谱模拟图
16 .     Compound TBDMS ether
    相似度:55.5%
Bioorganic & Medicinal Chemistry Letters          2007          17          2634-2638
Epoxygenase eicosanoids: Synthesis of tetrahydrofuran-diol metabolites and their vasoactivity
J.R. Falck, L. Manmohan Reddy, Kihwan Byun, William B. Campbell, Xiu-Yu Yi
Structure      13C NMR   碳谱模拟图
17 .     13-dideacetyl-9,10-debenzoyltaxchinin C
    相似度:55.5%
Chinese Traditional and Herbal Drugs          2008          39          347-350
东北红豆杉针叶中紫杉烷类化学成分的研究
霍长虹;张嫚丽;李力更;李存芳;史清文
Structure      13C NMR   碳谱模拟图
18 .     Klysimplexin S
C26H42O7     相似度:55.5%
Organic & Biomolecular Chemistry          2011          9          834-844
Klysimplexins I–T, eunicellin-based diterpenoids from the cultured soft coral Klyxum simplex
Bo-Wei Chen, Chih-Hua Chao, Jui-Hsin Su, Chung-Wei Tsai, Wei-Hsien Wang, Zhi-Hong Wen, Chiung-Yao Huang, Ping-Jyun Sung, Yang-Chang Wu and Jyh-Horng Sheu
Structure      13C NMR   碳谱模拟图
19 .     3-{2-[(4bS,8R)-2-isopropyl-4b,8-dimethyl-8-(methoxycarbonyl)-4b,5,6,7,8,8a,9,10-octahydrophenanthren-3-yl]-2-oxoethyl}-1Н-imidazol-3-olium bromide,hydrate
C26H35BrN2O3     相似度:55.5%
Russian Journal of Organic Chemistry          2011          47          230-235
N-heterocyclic carbenes: III. N-heterocyclic carbene ligands based on abietane in Suzuki-Miyaura reaction
V. A. Glushkov, M. S. Valieva, O. A. Maiorova, E. V. Baigacheva and A. A. Gorbunov
Structure      13C NMR   碳谱模拟图
20 .     sarcophytonin G
C22H34O4     相似度:55.5%
Bulletin of the Chemical Society of Japan          2012          85          920-922
Sarcophytonins F and G, New Dihydrofuranocembranoids from a Dongsha Atoll Soft Coral Sarcophyton sp.
Shin-Pin Chen, Bo-Wei Chen, Chang-Feng Dai, Ping-Jyun Sung, Yang-Chang Wu, Jyh-Horng Sheu
Structure      13C NMR   碳谱模拟图
21 .     12-acetyl-N,N(tetrachlorophthaloyl)dehydroabietylamine
C30H31Cl4NO3     相似度:55.5%
Tetrahedron          2013          69          43-49
First synthesis of ring-B C60-substituted derivatives of N,N-(tetrachlorophthaloyl)dehydroabietylamine
Zhi Zhou, Zhong-Xiang Lin, Dan Liang, Jun-Qiang Hu
Structure      13C NMR   碳谱模拟图
22 .     15,16-Epoxy-2α-benzoyloxycleroda-3,13(16),14-trien-18-oic acid
C27H32O5     相似度:55.5%
Journal of Natural Products          2011          74          650-657
In Vivo Activity of Benzoyl Ester Clerodane Diterpenoid Derivatives from Dodonaea polyandra
Bradley S. Simpson, David J. Claudie, Jacobus P. Gerber, Simon M. Pyke, Jiping Wang, Ross A. McKinnon, and Susan J. Semple
Structure      13C NMR   碳谱模拟图
23 .     laevigatbenzoate
C27H32O5     相似度:55.5%
Journal of Natural Medicines          2011          65          391-394
Laevigatbenzoate from Croton laevigatus Vahl.
Guo-An Zou ,Hong-Wu Zhang ,Haji Akber Aisa ,Jun-Shan Yang ,Chao-Zhong Peng ,Zhong-Mei Zou
Structure      13C NMR   碳谱模拟图
24 .     p-Tolyl 2-O-tert-butyldiphenylsilyl-3-O-levulinoyl-5,6-Oisopropylidene-1-thio-β-D-galactofuranoside
C37H46O7SiS     相似度:55.1%
Tetrahedron          2012          68          3795-3802
Synthesis of tetra- and hexasaccharide fragments corresponding to the O-antigenic polysaccharide of Klebsiella pneumoniae
San-Yong Zhu, Jin-Song Yang
Structure      13C NMR   碳谱模拟图
25 .     6-O-(2-(azidomethyl)benzoyl)-2-O-benzoyl-4-O-benzyl-3-O-tert-butyldimethylsilyl-β-D-glucopyranoside
C36H45N3O7SiS     相似度:55.1%
Bioorganic & Medicinal Chemistry          2012          20          3898-3914
Synthesis of β(1,3) oligoglucans exhibiting a Dectin-1 binding affinity and their biological evaluation
Hiroshi Tanaka, Tetsuya Kawai, Yoshiyuki Adachi, Shinya Hanashima, Yoshiki Yamaguchi, Naohito Ohno, Takashi Takahashi
Structure      13C NMR   碳谱模拟图
26 .     17-benzoyloxy-3-O-(2,3-dimethylbutanoyl)-20-deoxyingenol
C33H42O7     相似度:54.8%
Phytochemistry          2008          69          812-819
Ingenane diterpenoids from Euphorbia esula
Zhi-Qiang Lu, Min Yang, Jin-Qiang Zhang, Guang-Tong Chen, Hui-Lian Huang,Shu-Hong Guan, Chao Ma, Xuan Liu, De-An Guo
Structure      13C NMR   碳谱模拟图
27 .     (R)-MTPA ester
C22H30O4     相似度:54.8%
Bioscience, Biotechnology, and Biochemistry          2003          66          655-659
Myrsinoic Acids B, C and F, Anti-inflammatory Compounds from Myrsine seguinii
Mitsuru HIROTA, Shintaro MIYAZAKI, Tomomi MINAKUCHI, Tomoko TAKAGI and Hisao SHIBATA
Structure      13C NMR   碳谱模拟图
28 .     (S)-MTPA ester
C22H30O4     相似度:54.8%
Bioscience, Biotechnology, and Biochemistry          2003          66          655-659
Myrsinoic Acids B, C and F, Anti-inflammatory Compounds from Myrsine seguinii
Mitsuru HIROTA, Shintaro MIYAZAKI, Tomomi MINAKUCHI, Tomoko TAKAGI and Hisao SHIBATA
Structure      13C NMR   碳谱模拟图
29 .     compound 4a
    相似度:53.5%
Heterocycles          2006          70          71-75
Synthesis of Novel Silacyclobutene Derivatives Utilizing Zirconocene- and Titanocene-Ethylene Complexes
Chung Keun Jin, Tinh Van Dang, Yoshifumi Ikee, Toshiaki Yamada, Shigeki Sano, Motoo Shiro, and Yoshimitsu Nagao*
Structure      13C NMR   碳谱模拟图
30 .     compound 1
C28H44O7     相似度:53.5%
Tetrahedron          2011          67          7289-7293
New premyrsinane-type diterpene polyesters from Euphorbia falcata
Edvárd Sulyok, Andrea Vasas, Dóra Rédei, Peter Forgo, Zoltán Kele, Gyula Pinke, Judit Hohmann
Structure      13C NMR   碳谱模拟图
我有一个梦想,我想当校长
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