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zhjy12345

金虫 (小有名气)

[求助] 求微谱查一化合物

13C NMR (100 MHz, CDCl3) δ 14.09,  19.70,  20.51, 22.66, 24.65,  25.48,27.15 ,  
29.82, 31.48 ,31.89,34.04 ,37.35 ,39.44,42.63, 54.14, 58.50 ,104.83,116.89 ,
127.10, 128.19 ,129.97 ,131.90 ,179.88
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zhjy12345: 金币+20 2012-07-14 13:13:38
1 .     dictyosphaerin
C22H34O3     相似度:65.2%
Journal of Natural Products          1996          59          1154-1156
Dictyosphaerin: A Novel Bicyclic Lipid from a Southern Australian Marine Green Algae, Dictyosphaeria sericea
Simone J. Rochfort, Russell Watson, and Robert J. Capon
Structure      13C NMR   碳谱模拟图
2 .     phenylacetylricinoleic acid
    相似度:65.2%
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
3 .     compound
C24H30NO4Si     相似度:65.2%
Tetrahedron          2005          61          1187-1198
Enantioselective syntheses of two 5, 9E diastereomers of 223V, an alkaloid from the poison frog Dendrobates pumilio
Naoki Toyooka, Hideo Nemoto, Masashi Kawasaki, H. Martin Garraffo, Thomas F. Spande, John W. Daly
Structure      13C NMR   碳谱模拟图
4 .     dictyosphaerin methyl ester
C23H36O3     相似度:60.8%
Journal of Natural Products          1996          59          1154-1156
Dictyosphaerin: A Novel Bicyclic Lipid from a Southern Australian Marine Green Algae, Dictyosphaeria sericea
Simone J. Rochfort, Russell Watson, and Robert J. Capon
Structure      13C NMR   碳谱模拟图
5 .     turraeanin C
C23H36O4     相似度:60.8%
Planta Medica          2005          71          1145-1151
Novel Antimicrobial Diterpenoids from Turraeanthus africanus
Simplice Joel N. Tatsimo,Pierre Tane, Pullela V.Srinivas,Beibam L. Sondengam, Jacob Melissa,Christopher O. Okunji,Brian M. Schuster,Maurice M. Iwu,Ikhlas A. Khan
Structure      13C NMR   碳谱模拟图
6 .     secolincomolide B Keto form
C23H40O5     相似度:60.8%
Planta Medica          2002          68          142-145
Cytotoxic Butanolides and Secobutanolides from the Stem Wood of Formosan Lindera communis
Ian-Lih Tsai,Chao-Hui Hung ,Chang-Yih Duh,Ih-Sheng Chen
Structure      13C NMR   碳谱模拟图
7 .     3-Hydroxy-19-nor-17α -pregna-1,3,5(10)-triene-21(R orS),17-carbo-methyl-O-lactol
C22H30O3     相似度:60.8%
Steroids          2004          69          325-342
Inhibition of type 2 17β-hydroxysteroid dehydrogenase by estradiol derivatives bearing a lactone on the D-ring: structure–activity relationships
Patrick Bydal, Serge Auger, Donald Poirier
Structure      13C NMR   碳谱模拟图
8 .     stanozolol
    相似度:60.8%
Steroids          1992          57          306-312
Studies on anabolic steroids. 9. Tertiary sulfates of anabolic 17α-methyl steroids: synthesis and rearrangement
Honggang Bi, Robert Massé, George Just
Structure      13C NMR   碳谱模拟图
9 .     (17(20)E)-3β-hydroxy-17-(4,5-dihydro-1,3-oxazol-2-ylmethylene)androst-5-ene
C23H33NO2     相似度:60.8%
Steroids          2012          77          77-84
Synthesis of 21-nitrogen substituted pregna-5,17(20)-dienes from pregnenolone
Sergey V. Stulov, Yaroslav V. Tkachev, Roman A. Novikov, Maria G. Zavialova, Vladimir P. Timofeev, Alexander Yu. Misharin
Structure      13C NMR   碳谱模拟图
10 .     8-O-acetylmycothiazole
C24H34N2O4S     相似度:60.8%
Bioorganic & Medicinal Chemistry          2010          18          5988-5994
The marine sponge metabolite mycothiazole: A novel prototype mitochondrial complex I inhibitor
J. Brian Morgan, Fakhri Mahdi, Yang Liu, Veena Coothankandaswamy, Mika B. Jekabsons, Tyler A. Johnson, Koneni V. Sashidhara, Phillip Crews, Dale G. Nagle, Yu-Dong Zhou
Structure      13C NMR   碳谱模拟图
11 .     allohimachalol (R)-OMTP ester
    相似度:60.8%
Tetrahedron          1999          55          759-770
Allohimachalane, seco-allohimachalane and himachalane sesquiterpenes from Illicium tsangii
Koon-Sin Ngo, Geoffrey D. Brown
Structure      13C NMR   碳谱模拟图
12 .     (3S,20R)-(3-hydroxypregn-7-en-20-yl)-ethanal
    相似度:60.8%
Bioorganic & Medicinal Chemistry          2009          17          8123-8137
Side chain azasteroids and thiasteroids as sterol methyltransferase inhibitors in ergosterol biosynthesis
Delphine Renard, Johann Perruchon, Martin Giera, J?rg Müller, Franz Bracher
Structure      13C NMR   碳谱模拟图
13 .     3β-Acetoxy-5β-pregnan-12,20-dione
C23H34O4     相似度:60.8%
Steroids          2011          76          1166-1175
Norrish–Prins reaction as a key step in the synthesis of 14β-hydroxy-5α (or 5β or Δ5,6)-pregnane derivatives
Philippe Geoffroy, Blandine Ressault, Eric Marchioni, Michel Miesch
Structure      13C NMR   碳谱模拟图
14 .     1-((1R,2S,5R)-8-phenylmenthoxycarbonyl)-5-triisopropylsilyl-(R)-2-triphenylsilyl-2,3,-dihydro-4-pyridone
C49H63NO3Si2     相似度:60%
Heterocycles          2002          58          505-519
Synthesis and Reactions of Enantiopure 1-Acyl-2-[triaryl(alkyl)silyl]-2,3-dihydro-4-pyridones
Daniel L. Comins,* Michael O. Killpack, Emilie Despagnet, and Emmanuel Zeller
Structure      13C NMR   碳谱模拟图
15 .     3β-Acetoxy-16β-hydroxy-5β-bisnorcholanoic acid 22→16 lactone
    相似度:58.3%
Steroids          2011          76          317-323
Studies on the BF3·Et2O catalyzed Baeyer-Villiger reaction of spiroketalic steroidal ketones
Mariana Macias-Alonso, Jacek W. Morzycki, Martin A. Iglesias-Arteaga
Structure      13C NMR   碳谱模拟图
16 .     3β-Acetoxy-16-hydroxy-5β-dinorcholanic acid-(22→16) lactone
    相似度:58.3%
Steroids          2012          77          819-828
BF3·Et2O-induced stereoselective aldol reaction with benzaldehyde, and steroid sapogenins and its application to a convenient synthesis of dinorcholanic lactonesOriginal Research Article
Karen M. Ruíz-Pérez, Margarita Romero-ávila, Verónica Tinajero-Delgado, Marcos Flores-álamo, Martín A. Iglesias-Arteaga
Structure      13C NMR   碳谱模拟图
17 .     (2S,3R)-(-)-3-butyl-2-(tert-butyldiphenylsilanyl-oxymethyl)-6-tri?uoromethane-sulfonyloxy-3,4-di-hydro-2H-pyridine-1-carboxylic acid methyl ester
C29H38NO6F3SSi     相似度:58.3%
Tetrahedron          2005          61          1187-1198
Enantioselective syntheses of two 5, 9E diastereomers of 223V, an alkaloid from the poison frog Dendrobates pumilio
Naoki Toyooka, Hideo Nemoto, Masashi Kawasaki, H. Martin Garraffo, Thomas F. Spande, John W. Daly
Structure      13C NMR   碳谱模拟图
18 .     2-formyl-17α-benzyl-17β-hydroxyestra-1,3,5(10)-triene
C26H30O3     相似度:58.3%
Bioorganic & Medicinal Chemistry          2011          19          5999-6005
Inhibition of steroid sulfatase with 4-substituted estrone and estradiol derivatives
Chau-Minh Phan, Yong Liu, Byoung-moo Kim, Yaser Mostafa, Scott D. Taylor
Structure      13C NMR   碳谱模拟图
19 .     17β-[2'-(Phenyl)-4 ',5' -dihydro-6' H-1' ,3' -oxazin-6 '-yl]androst-5-en-3β-ol
C29H39O2N     相似度:57.6%
Steroids          2006          71          809-816
Stereoselective synthesis of some 17β-dihydrooxazinyl steroids, as novel presumed inhibitors of 17α-hydroxylase-C17,20-lyase
János W?lfling, éva Andrea Oravecz, Dóra Ondré, Erzsébet Mernyák, Gyula Schneider, István Tóth, Mihály Szécsi, János Julesz
Structure      13C NMR   碳谱模拟图
20 .     17β-[2' -(4''-Chlorophenyl)-4' ,5' -dihydro-6 'H-1' ,3 '-oxazin-6' -yl]androst-5-en-3β-ol
C29H38O2NCl     相似度:57.6%
Steroids          2006          71          809-816
Stereoselective synthesis of some 17β-dihydrooxazinyl steroids, as novel presumed inhibitors of 17α-hydroxylase-C17,20-lyase
János W?lfling, éva Andrea Oravecz, Dóra Ondré, Erzsébet Mernyák, Gyula Schneider, István Tóth, Mihály Szécsi, János Julesz
Structure      13C NMR   碳谱模拟图
21 .     ergosta-5,24(24')-diene-3β,4β,20S-triol
C28H46O3     相似度:57.1%
Phytochemistry          1997          44          153-155
Ergosta-5, 24(24')-diene-3β, 4β, 20S-triol, an ergostane steroid from Dysoxylum malabaricum
T. R. Govindachari, G. N. Krishna Kumari, G. Suresh
Structure      13C NMR   碳谱模拟图
22 .     Testosterone cis-non-6-enoate
C28H42O3     相似度:57.1%
Steroids          1990          55          36-39
Long-acting contraceptive agents: testosterone esters of unsaturated acids
C. G. Francisco, R. Freire, J. Gawronski, R. Hernández, M. Kielczewski, J. A. Salazar, F. Savabi, A. Shafiee, L. Strekowski, E. Suárez
Structure      13C NMR   碳谱模拟图
23 .     4-甲基胆甾-7,24-二烯-3β-醇
    相似度:57.1%
Chinese Journal of Medicinal Chemistry          2005          15          100-102
Study of the chemical constituents from Asterias rollentias Bell.
ZHAN Yong-cheng, DONG Zhen-min, LIU Tao, PEI Yue-hu
Structure      13C NMR   碳谱模拟图
24 .     gymnastatins H
C24H35NO4     相似度:56.5%
Journal of Natural Products          2006          69          1384-1388
Gymnastatins F?H, Cytostatic Metabolites from the Sponge-Derived Fungus Gymnascella dankaliensis
Taro Amagata, Katsuhiko Minoura, and Atsushi Numata
Structure      13C NMR   碳谱模拟图
25 .     (1S,3E,7E,11R)-(+)-verticilla-3,7,12(18)-triene
    相似度:56.5%
Journal of Natural Products          2005          68          1598-1602
Verticillane Derivatives from Bursera suntui and Bursera kerberi
Juan D. Hernndez-Hernndez, Luisa U. Romn-Marn, Carlos M. Cerda-Garca-Rojas, and Pedro Joseph-Nathan
Structure      13C NMR   碳谱模拟图
26 .     (1R,7E,11Z)-(-)-verticilla-4(20),7,11-triene
    相似度:56.5%
Journal of Natural Products          2005          68          1598-1602
Verticillane Derivatives from Bursera suntui and Bursera kerberi
Juan D. Hernndez-Hernndez, Luisa U. Romn-Marn, Carlos M. Cerda-Garca-Rojas, and Pedro Joseph-Nathan
Structure      13C NMR   碳谱模拟图
27 .     9α-hydroxycanrenone
C22H29O4     相似度:56.5%
Journal of Natural Products          2003          66          350-356
Biotransformations of the Cardiovascular Drugs Mexrenone and Canrenone
Carol L. Preisig, Jodi A. Laakso, Ursula M. Mocek, Ping T. Wang, Julio Baez, and Graham Byng
Structure      13C NMR   碳谱模拟图
28 .     (S)-N,β,β-Trimethylphenylalanyl-(S)-tert-leucyl-(2e,4S)-N-methyl-4-amino-2,5-dimethylhex-2-enoic acid
C27H43N3O4     相似度:56.5%
Journal of Natural Products          2003          66          183-199
Synthesis and Antimitotic/Cytotoxic Activity of Hemiasterlin Analogues
James A. Nieman, John E. Coleman, Debra J. Wallace, Edward Piers, Lynette Y. Lim, Michel Roberge, and Raymond J. Andersen
Structure      13C NMR   碳谱模拟图
29 .     daphnimacropodine A
C22H31NO3     相似度:56.5%
Journal of Natural Products          2007          70          1348-1351
Daphnimacropodines A-D, Alkaloids from Daphniphyllum macropodum
Ning-Chuan Kong,Hong-Ping He, Yue-Hu Wang, Shu-Zhen Mu, Ying-Tong Di, and Xiao-Jiang Hao
Structure      13C NMR   碳谱模拟图
30 .     methyl (5Z)-9,15-dioxoprosta-5,8(12)-dien-1-oate
C21H32O4     相似度:56.5%
Journal of Natural Products          2000          63          1425-1426
A Rare Prostaglandin from the Soft Coral Sarcophyton crassocaule of the Indian Ocean
A. S. R. Anjaneyulu,M. V. R. Krishna Murthy, P. Mangala Gowri, M. J. R. V. Venugopal, and Hartmut Laatsch
Structure      13C NMR   碳谱模拟图
31 .     cholest-7-en-3β-ol
C27H46O     相似度:56.5%
Chemical & Pharmaceutical Bulletin          1982          30          2780-2786
Studies on the Constituents of Pollen. X. On the Constituents of Pollen Grains of Ambrosia elatior LINNE (2)
TAICHI OHMOTO,KEIJI IKEDA and TAKEO CHIBA
Structure      13C NMR   碳谱模拟图
32 .     4-epiisocembrol
    相似度:56.5%
Chemistry of Natural Compounds          1983          19          141-148
OXIDATIVE TRANSFORMATIONS OF CEMBRANE DITERPENOIDS. V. REACTION OF CEMBRENE WITH N-BROMOSUCCINIMIDE IN AQUEOUS ACETONE
V. A. Raldugin, N. I. Yaroshenko, and M. M. Shakirov
Structure      13C NMR   碳谱模拟图
33 .     3-Hydroxy-19-nor-17α -pregna-1,3,5(10)-triene-21(R orS),17-carbo-methyl-O-lactol
    相似度:56.5%
Steroids          2004          69          325-342
Inhibition of type 2 17β-hydroxysteroid dehydrogenase by estradiol derivatives bearing a lactone on the D-ring: structure–activity relationships
Patrick Bydal, Serge Auger, Donald Poirier
Structure      13C NMR   碳谱模拟图
34 .     3α-Hydroxy-2β-(phenyl-amino)-5α-androst-17-one
C25H35NO2     相似度:56.5%
Steroids          2006          71          706-711
Facile ring opening of 2,3-epoxy-steroids with aromatic amines in ionic liquids
Anita Horváth, Rita Skoda-F?ldes, Sándor Mahó, Zoltán Berente, László Kollár
Structure      13C NMR   碳谱模拟图
35 .     fregenedadiol
    相似度:56.5%
Natural Product Research          1993          3          173-176
Synthesis of Fregenedadiol Dimethyl Ether
J. G. Urones; I. S. Marcos; P. Basabe; N. M. Garrido; A. Jorge; R. F. Moro; A. M. Lithgow
Structure      13C NMR   碳谱模拟图
36 .     Methyl 5R,6S-diHETE
C21H34O4     相似度:56.5%
Phytochemistry          2000          53          129-133
5-Lipoxygenase-derived oxylipins from the red alga Rhodymenia pertusa
Zhi Dong Jiang, Sharon O. Ketchum, William H. Gerwick
Structure      13C NMR   碳谱模拟图
37 .     ent-11α-hydroxyatis-13,16-diene
C20H30O     相似度:56.5%
Journal of Natural Products          1989          Vol 52          669
Acid-Catalyzed Rearrangement of ent-Atis-13,16-dienes
E. Cabrera, A. Garcia-Granados, M. Hervas
Structure      13C NMR   碳谱模拟图
38 .     compound 6
C23H32O4     相似度:56.5%
Journal of Natural Products          1990          Vol 53          753
The Acid-Catalyzed Rearrangement and Absolute Stereochemistry of Isospongiaquinone
Robert J. Capon
Structure      13C NMR   碳谱模拟图
39 .     compound 5
    相似度:56.5%
Journal of Natural Products          1990          Vol 53          1374
An Acid-Catalyzed Isomerization of Isoatisine
Haridutt K. Desai, Qingping Jiang, S. William Pelletier
Structure      13C NMR   碳谱模拟图
40 .     9,12,15-octadecatrienoic acid
    相似度:56.5%
Natural Product Sciences          2004          10          335-340
Phytochemical Constituents of the Aerial Parts from Aster hispidus
Lee, Sung-Ok; Choi, Sang-Zin; Choi, Sang-Un; Ryu, Shi-Yong; Lee, Kang-Ro
Structure      13C NMR   碳谱模拟图
41 .     3-α-acetyloxy-5α-pregn-17(20)-(cis)-en-16-one
C23H34O3     相似度:56.5%
Phytochemistry          1995          39          1403-1409
Steroids and terpenoids from the gum resin of Ailanthus grandis
T. Hung, H. Stuppner, E. P. Ellmerer-Müller, D. Scholz, D. Eigner, M. P. Manandhar
Structure      13C NMR   碳谱模拟图
42 .     18-acetoxy-friedolabd-5-en-15-oic acid
C22H36O4     相似度:56.5%
Phytochemistry          1991          30          3669-3677
Friedolabdanes and other constituents from chileanHaplopappus species
C. Zdero, F. Bohlmann, H.M. Niemeyer
Structure      13C NMR   碳谱模拟图
43 .     Isopseudopteroxazole
C21H27NO     相似度:56.5%
Journal of Natural Products          2011          74          2250-2256
One-Pot Syntheses of Pseudopteroxazoles from Pseudopterosins:A Rapid Route to Non-natural Congeners with Improved Antimicrobial Activity
Malcolm W. B. McCulloch, Fabrice Berrue, Brad Haltli, and Russell G. Kerr
Structure      13C NMR   碳谱模拟图
44 .     (3R*,4S*,8R*,9S*,13R*,14R*)-16-Hydroxy-9-acetoxy-8-epi-isosphaerodiene-2
C22H34O3     相似度:56.5%
Marine drugs          2009          7          184-195
Sphaeroane and Neodolabellane Diterpenes from the Red Alga Sphaerococcus coronopifolius
Vangelis Smyrniotopoulos,Constantinos Vagias and Vassilios Roussis
Structure      13C NMR   碳谱模拟图
45 .     compound 7c
    相似度:56.5%
Tetrahedron Letters          2000          41          2719-2722
Amine induced carbonylation of alkynes to cyclobutenediones using Fe3(CO)12
Chellappan Rameshkumar, Mariappan Periasamy
Structure      13C NMR   碳谱模拟图
46 .     10-hydroxy ent-cembrene
C20H32O     相似度:56.5%
Phytochemistry          1988          27          1685-1693
Biosynthetic precursors for α-and β-cembrenediol formation in tobacco
Leslie Crombie,Desmond McNamara,David F. Firth,Sue Smith,Peter C. Bevan
Structure      13C NMR   碳谱模拟图
47 .     bromosphaerol
    相似度:56.5%
Phytochemistry          1988          27          1875-1878
Terpenes from the red alga Sphaerococcus coronopifolius of the north Adriatic Sea
Salvatore de Rosa,Salvatore de Stefano,Paola Scarpelli,Nevenka Zavodnik
Structure      13C NMR   碳谱模拟图
48 .     pseudopteroxazole
C21H28NO     相似度:56.5%
Organic letters          1999          1          527-530
Novel Antimycobacterial Benzoxazole Alkaloids, from the West Indian Sea Whip Pseudopterogorgia elisabethae
Abimael D. Rodríguez, Catherine Ramírez, Ileana I. Rodríguez, and Eduvigis González
Structure      13C NMR   碳谱模拟图
49 .     5-(4-isopropylphenyl)-2-methyl-3b,6a,6b,7,8,9,9a-heptahydro-1H,5H-cyclopenta[g]pyrrolo[3,4-e]indole-4,6-dione
C23H26N2O2     相似度:56.5%
Journal of Heterocyclic Chemistry          2009          46          503-534
In situ vinylpyrrole synthesis. Diels-Alder reactions with maleimides to give tetrahydroindoles
Wayland E. Noland,Nicholas P. Lanzatella,Elena P. Sizova,Lakshmanan Venkatraman and Oleg V. Afanasyev
Structure      13C NMR   碳谱模拟图
50 .     4-(2-methyl-4,6-dioxo-3b,6a,6b,7,8,9,9a-heptahydro-1H,5H-cyclopenta[g]pyrrolo[3,4-e]-5-indolyl) benzoic acid
C21H20N2O4     相似度:56.5%
Journal of Heterocyclic Chemistry          2009          46          503-534
In situ vinylpyrrole synthesis. Diels-Alder reactions with maleimides to give tetrahydroindoles
Wayland E. Noland,Nicholas P. Lanzatella,Elena P. Sizova,Lakshmanan Venkatraman and Oleg V. Afanasyev
Structure      13C NMR   碳谱模拟图
51 .     17β-hydroxy-4-androsteno[3,2-d]-2'-amino-6'-ethoxypyrimidine
    相似度:56.5%
Indian Journal of Chemistry          2006          45B          959-966
A facile synthesis of steroidal pyrazoles,isoxazoles and pyrimidines from testosterone
Singh,Ch Brajakishor; Singh,L Warjeet
Structure      13C NMR   碳谱模拟图
52 .     (9Z,12Z)-6-hydroxy-7,9,12-octadecatrienoic acid
C18H30O3     相似度:56.5%
Heterocycles          2010          80          689-695
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Structure      13C NMR   碳谱模拟图
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