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kardinalxing

木虫 (正式写手)

半猪半虎

[求助] 帮忙查下微谱数据,金币好商量!

帮忙查一下:
化合物1  
13.98, 22.48,24.60, 25.07, 27.99, 28.83, 28.99, 29.29, 29.71, 31.48, 33.22, 33.45, 69.87,  73.91, 75.62, 127.87,13 6.72, 145.29, 159.80    溶剂为氘氯仿 溶剂峰分别为76.58, 77.00,  77.43, 78.04
希望高手帮忙查下  谢谢!
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1 .     Embeliaribyl ester
C44H86O3     相似度:73.6%
Pharmazie          2005          60          69-71
New compounds from the seeds of Embelia ribes Burm
K. Haq, M. Ali, and A. W. Siddiqui
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     compound 9
    相似度:73.6%
Australian Journal of Chemistry          1991          44          843-854
Epoxy Lipids From the Australian Epiphytic Brown Alga Notheia anomala. II.
LM Murray, RA Barrow and RJ Capon
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     (±)-coriolic acid
    相似度:73.6%
Shoyakugaku Zasshi          1987          41          174-179
Studies on the Crude Drug Containing the Angiotensin I Converting Enzyme Inhibitors (II) : On the Active Principles of Fritillaria verticillata WILLDENOW var. thumber gii BAKER
NIITSU KAZUAKI,Tsumura Laboratory, IKEYA YUKINOBU,Tsumura Laboratory, et al.
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     α-palmitoyl-β-linoleoyl-α'-linoleoyl glycerol
    相似度:70%
Fitoterapia          2006          77          296-299
Triglycerides from Urena lobata
Carlo F. Morelli, Paola Cairoli , Giovanna Speranza , Mahiuddin Alamgir ,Sultana Rajia
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     compound 3
C18H30O3     相似度:68.4%
Journal of Natural Products          2002          65          1712-1714
Aldehyde Dehydrogenase Inhibitors from the Mushroom Clitocybe clavipes
Hirokazu Kawagishi, Toshiyuki Miyazawa,Hiroko Kume,Yasushi Arimoto, and Takahiro Inakuma
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     (9R,10E,12S,13S)-9,12,13-Trihydroxyoctadec-10-enoic Acid
    相似度:68.4%
Helvetica Chimica Acta          2009          92          2052-2057
Synthesis of (-)-Pinellic Acid and Its (9R,12S,13S)-Diastereoisomer
Gowravaram Sabitha, Martha Bhikshapathi, Erigala Venkata Reddy, Jhillu S. Yadav
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     9,10-Dihydroxystearic acid
    相似度:68.4%
Steroids          2008          73          1098-1109
Synthesis of highly pure oxyphytosterols and (oxy)phytosterol esters: Part II. (Oxy)-sitosterol esters derived from oleic acid and from 9,10-dihydroxystearic acid [1]
Diane Julien-David, Philippe Geoffroy, Eric Marchioni, Françis Raul, Dalal Aoudé-Werner, Michel Miesch
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     compound 8a
    相似度:68.4%
Tetrahedron Letters          2005          46          2487-2490
Allylic oxidation: easy synthesis of alkenones from activated alkenes with TEMPO
Tony Breton, Denis Liaigre, El Mustapha Belgsir
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     compound 8b
    相似度:68.4%
Tetrahedron Letters          2005          46          2487-2490
Allylic oxidation: easy synthesis of alkenones from activated alkenes with TEMPO
Tony Breton, Denis Liaigre, El Mustapha Belgsir
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     compound 8c
    相似度:68.4%
Tetrahedron Letters          2005          46          2487-2490
Allylic oxidation: easy synthesis of alkenones from activated alkenes with TEMPO
Tony Breton, Denis Liaigre, El Mustapha Belgsir
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     (9Z,11E)-13-oxo-9,11-ocatadecadienoic acid
C18H30O3     相似度:68.4%
Bioscience, Biotechnology, and Biochemistry          2000          64          882-886
(10E,12Z,15Z)-9-Hydroxy-10,12,15-octadecatrienoic Acid Methyl Ester as an Anti-inflammatory Compound from Ehretia dicksonii
Mei DONG, Yukiko ODA, Mitsuru HIROTA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     9,12-octadecadienoic acid (Z,Z)-2,3-dihydroxypropyl ester
C21H38O4     相似度:68.4%
Natural Product Research and Development          2010          22          998-1000
Chemical Constituents and Identification of the Caules of Clematis armandii Franch. and Clematis montana Buch.-Ham.
LIU Jing-jing;CHEN Xing; WEI Zhi-qi; LI Bin
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     (-)-(13S,9Z,11E)-13-hydroxy-9,11-ocatadecadienoic acid methyl ester
    相似度:68.4%
Tetrahedron          1997          53          617-624
The chemoenzymatic synthesis of(S)-13-hydroxyoctadeca-(9Z, 11E)-dienoic acid using the hydroxynitrile lyase from Hevea brasiliensis
Dean V. Johnson, Herfried Griengl
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     (6S,7R,9R,10R)-6,9-epoxynonadec-18-ene-7,10-diol
C19H36O3     相似度:68.4%
Tetrahedron          1998          54          2227-2242
Marine nematocides: Tetrahydrofurans from a southern Australian brown alga, Notheia anomala
Robert J. Capon, Russell A Barrow, Simone Rochfort, Michael Jobling, Colin Skene, Ernest Lacey, Jennifer H Gill, Thomas Friedel, David Wadsworth
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     methyl (9S,10S,12S,13S)-10,13-epoxy-9,12-dihydroxyoctadecanonate
    相似度:68.4%
Tetrahedron          1998          54          2227-2242
Marine nematocides: Tetrahydrofurans from a southern Australian brown alga, Notheia anomala
Robert J. Capon, Russell A Barrow, Simone Rochfort, Michael Jobling, Colin Skene, Ernest Lacey, Jennifer H Gill, Thomas Friedel, David Wadsworth
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     (6S,7S,9R,10R)-6,9-epoxynonadec-18-ene-7,10-diol
    相似度:68.4%
Australian Journal of Chemistry          1990          43          895-911
Epoxy Lipids From the Australian Epiphytic Brown Alga Notheia anomala
RA Barrow and RJ Capon
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

17 .     (9E,11Z) 14-Hydroxyoctadecan-9,11-dienoic acid
C18H32O3     相似度:68.4%
Natural Product Communications          2006          1          101-107
Constituents of Erythrina lysistemon: Their Brine ShrimpLethality, Antimicrobial and Radical Scavenging Activities
Benard F. Juma and Runner R. T. Majinda
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

18 .     (9S,10E,12Z)-9-Hydroxy-10,12-octadecadienoic Acid
C18H32O3     相似度:68.4%
Journal of Agricultural and Food Chemistry          2008          56          5062-5068
Isolation and Identification of Antifungal Fatty Acids from the Basidiomycete Gomphus floccosus
Charles L. Cantrell, Bethany P. Case, E. Edward Mena, Toby M. Kniffin, Stephen O. Duke and David E. Wedge
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     (9E,11Z)-13-Oxo-9,11-octadecadienoic Acid
C18H30O3     相似度:68.4%
Journal of Agricultural and Food Chemistry          2008          56          5062-5068
Isolation and Identification of Antifungal Fatty Acids from the Basidiomycete Gomphus floccosus
Charles L. Cantrell, Bethany P. Case, E. Edward Mena, Toby M. Kniffin, Stephen O. Duke and David E. Wedge
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     Nonanoate
C19H34O3     相似度:68.4%
Journal of Agricultural and Food Chemistry          2002          50          3522-3526
Antimicrobial and Bactericidal Activities of Esters of 2-endo-Hydroxy-1,8-cineole as New Aroma Chemicals
Mitsuo Miyazawa and Yuya Hashimoto

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2楼2013-01-16 17:50:51
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★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
kardinalxing: 金币+30, ★★★很有帮助, 谢谢 2013-01-16 18:17:45
带溶剂峰,查得
1 .     (3S,8R,9R,10R)-3-(tert-Butyldimethylsilyloxy)heptadeca-1-en-4,6-diyne-8,9,10-triol
C23H40O4Si     相似度:65.2%
Tetrahedron          2012          68          262-271
A flexible organocatalytic enantioselective synthesis of heptadeca-1-ene-4,6-diyne-3S,8R,9S,10S-tetrol and its congeners
Gullapalli Kumaraswamy, Kadivendi Sadaiah
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     4,6-Tricosadiynoic acid
    相似度:65.2%
Journal of the Brazilian Chemical Society          2001          12          64-72
Synthesis of the Diacetylenic Phospholipids 1,2-(10',12'-Heptadecadiynoyl)-sn-Glycero-3-Phophatidylcholine and 1,2-(4',6'-Tricosadiynoyl)-sn-Glycero-3-Phophatidylcholine
Paulo T. Hennies, Maria H. C. Santana and Carlos R. D. Correia
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     Di-O-alkadienyl ethers
C86H162O4     相似度:62.9%
Phytochemistry          1995          40          543-554
n-alkenylpyrogallol dimethyl ethers, aliphatic diol monoesters and some minor ether lipids from Botryococcus braunii a race
P. Metzger, Y. Pouet
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     1,2-(10',12'-Tricosadiynoyl)-sn-glycero-3-phophatidylcholine
C54H92NO8P     相似度:62.9%
Journal of the Brazilian Chemical Society          2001          12          64-72
Synthesis of the Diacetylenic Phospholipids 1,2-(10',12'-Heptadecadiynoyl)-sn-Glycero-3-Phophatidylcholine and 1,2-(4',6'-Tricosadiynoyl)-sn-Glycero-3-Phophatidylcholine
Paulo T. Hennies, Maria H. C. Santana and Carlos R. D. Correia
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     digonazole
C34H58N2O7     相似度:62.5%
Journal of Natural Products          1994          Vol 57          829
Amino Acid Derivatives from the Marine Sponge Jaspis digonoxea
Amira Rudi, Yoel Kashman, Yehuda Benayahu, Michael Schleyer
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     (9E)-(11S,12R,15R,16R)-19-benzyloxy-11-(methoxymethoxy)-12,15-oxido-9-nonadecen-16-ol
C28H46O5     相似度:62.5%
The Journal of Organic Chemistry          1998          63          7066-7071
Total Synthesis of the Nonadjacent Bis-Tetrahydrofuran Annonaceous Acetogenin Squamostatin-D
James A. Marshall and Hongjian Jiang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     compound 4
C21H36O5     相似度:60.8%
Journal of Natural Products          2002          65          1712-1714
Aldehyde Dehydrogenase Inhibitors from the Mushroom Clitocybe clavipes
Hirokazu Kawagishi, Toshiyuki Miyazawa,Hiroko Kume,Yasushi Arimoto, and Takahiro Inakuma
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     compound 15
    相似度:60.8%
Journal of Natural Products          1997          60          1251-1260
New Acylated Sulfoglycolipids and Digalactolipids and Related Known Glycolipids from Cyanobacteria with a Potential To Inhibit the Reverse Transcriptase of HIV-1
Vered Reshef, Erez Mizrachi, Tal Maretzki, Colin Silberstein, Shoshana Loya, Amnon Hizi, and Shmuel Carmeli
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     9,10-Di-tert-butyldimethylsilyloxystearic acid
C30H64O4Si2     相似度:60.8%
Steroids          2008          73          1098-1109
Synthesis of highly pure oxyphytosterols and (oxy)phytosterol esters: Part II. (Oxy)-sitosterol esters derived from oleic acid and from 9,10-dihydroxystearic acid [1]
Diane Julien-David, Philippe Geoffroy, Eric Marchioni, Françis Raul, Dalal Aoudé-Werner, Michel Miesch
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     α-palmitoyl-β-linoleoyl-α'-linoleoyl glycerol
    相似度:60.8%
Fitoterapia          2006          77          296-299
Triglycerides from Urena lobata
Carlo F. Morelli, Paola Cairoli , Giovanna Speranza , Mahiuddin Alamgir ,Sultana Rajia
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     (12Z)-4-phenyl-1-(9-hydroxy-octadec-12-enoyl)-thiosemicarbazide
C25H41N3O2S     相似度:60.8%
Indian Journal of Chemistry          2009          48B          97-102
Substituted 1,2,4-triazoles and thiazolidinones from fatty acids: Spectral characterization and antimicrobial activity
Banday,Mudasir Rashid; Rauf,Abdul
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     Compound 4
C35H67NO5     相似度:60.8%
Bioorganic & Medicinal Chemistry Letters          2007          17          3426-3430
Annonaceous acetogenin mimics bearing a terminal lactam and their cytotoxicity against cancer cells
Hai-Xia Liu, Guo-Rui Huang, Huan-Ming Zhang, Jia-Rui Wu, Zhu-Jun Yao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     phenylacetylricinoleic acid
    相似度:60.8%
Bioorganic & Medicinal Chemistry Letters          2010          20          3231-3234
Chemoenzymatic synthesis and cannabinoid activity of a new diazabicyclic amide of phenylacetylricinoleic acid
Manuel López-Ortíz, Andrea Herrera-Solís, Axel Luviano-Jardón, Nidia Reyes-Prieto, Ivan Castillo, Ivan Monsalvo, Patricia Demare, Mónica Méndez-Díaz, Ignacio Regla, Oscar Prospéro-García
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     Embeliaribyl ester
C44H86O3     相似度:60.8%
Pharmazie          2005          60          69-71
New compounds from the seeds of Embelia ribes Burm
K. Haq, M. Ali, and A. W. Siddiqui
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     compound 7a
C25H44O4     相似度:60.8%
Tetrahedron Letters          2003          44          1035-1037
Enantioselective synthesis of d-ribo-(2S,3S,4R)-C18-phytosphingosine using double stereodifferentiation
S.Vasudeva Naidu, Pradeep Kumar
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     AA005-d 4
C33H58D4O6     相似度:60.8%
Tetrahedron Letters          2005          46          3525-3528
Synthesis of a tetra-deuterium-labeled derivative of potent and selective anticancer agent AA005
Hai-Xia Liu, Zhu-Jun Yao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

17 .     (1R,6R)-6-(tert-Butyldimethylsilyloxy)-1-((4R,5S)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl)octa-7-en-2,4-diyn-1-ol
C26H44O4Si     相似度:60.8%
Tetrahedron          2012          68          262-271
A flexible organocatalytic enantioselective synthesis of heptadeca-1-ene-4,6-diyne-3S,8R,9S,10S-tetrol and its congeners
Gullapalli Kumaraswamy, Kadivendi Sadaiah
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

18 .     methyl (9S,10S,12S,13S)-10,13-epoxy-9,12-dihydroxyoctadecanonate
    相似度:60.8%
Tetrahedron          1998          54          2227-2242
Marine nematocides: Tetrahydrofurans from a southern Australian brown alga, Notheia anomala
Robert J. Capon, Russell A Barrow, Simone Rochfort, Michael Jobling, Colin Skene, Ernest Lacey, Jennifer H Gill, Thomas Friedel, David Wadsworth
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     (2S,3S,4R,2'S,3'S)-2-(2',3'-O-isopropylideneicosanoylamino)-1,3,4-docosanetriol
C49H89NO6     相似度:60.8%
Journal of Medicinal Chemistry          2006          49          5830-5839
Isolation, Structure Elucidation, Total Synthesis, and Evaluation of New Natural and Synthetic Ceramides on Human SK-MEL-1 Melanoma Cells
Francisco León, Ignacio Brouard, Augusto Rivera, Fernando Torres, Sara Rubio, José Quintana, Francisco Estévez, and Jaime Bermejo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     (6S,7S,9R,10R)-6,9-epoxynonadec-18-ene-7,10-diol 10-acetate
C21H38O4     相似度:60.8%
Australian Journal of Chemistry          1990          43          895-911
Epoxy Lipids From the Australian Epiphytic Brown Alga Notheia anomala
RA Barrow and RJ Capon
3楼2013-01-16 17:53:50
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kardinalxing

木虫 (正式写手)

半猪半虎

送鲜花一朵
引用回帖:
2楼: Originally posted by 新新手 at 2013-01-16 17:50:51
1 .     Embeliaribyl ester
C44H86O3     相似度:73.6%
Pharmazie          2005          60          69-71
New compounds from the seeds of Embelia ribes Burm
K. Haq, M. Ali, and A. W. Siddiqui
S ...

谢谢
坚持才有可能会成功!
4楼2013-01-16 18:18:09
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