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yjl2007

金虫 (正式写手)

[求助] 求助一化合物微谱数据结构

化合物数据:25.9, 26.2, 26.4, 27.9, 60.7, 70.3, 72.2, 73.3, 104.5, 109.4, 111.8
溶剂:CDCl3
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木虫 (小有名气)

【答案】应助回帖

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感谢参与,应助指数 +1
yjl2007: 金币+10 2012-06-13 09:36:09
1 .     compound 9
    相似度:91.6%
Archives of Pharmacal Research          1986          9          229-232
Oxidation of carbohydrates and a carbon-13 n.m.r. study of the keto sugars
Seung-Ho An
Structure     13C NMR   碳谱模拟图

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2 .     3-O-Allyl-1,2,4,5-di-O-isopropylidene-β-D-fructopyranose
C15H24O6     相似度:66.6%
Bioorganic & Medicinal Chemistry          2000          8          1825-1833
Synthesis and evaluation of fructose analogues as inhibitors of the d-fructose transporter GLUT5
Arnaud Tatibouët, Jing Yang, Christophe Morin, Geoffrey D. Holman
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




3 .     compound 9
    相似度:63.6%
Tetrahedron Letters          2000          41          3119-3122
Efficient synthesis of L-altrose and L-mannose
Shang-Cheng Hung, Cheng-Chung Wang, Shankar R. Thopate
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




4 .     (4S)-2'',2''-Dimethyl-propionic acid 2-(2,2-dimethyl-[1,3]-dioxolan-4-yl)-ethyl ester
C12H22O4     相似度:63.6%
Organic & Biomolecular Chemistry          2003          1          4173-4208
Total synthesis of (+)-phorboxazole A, a potent cytostatic agent from the sponge Phorbas sp.
Gerald Pattenden, Miguel A. González, Paul B. Little, David S. Millan, Alleyn T. Plowright, James A. Tornos and Tao Ye
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




5 .     1,2:5,6-di-O-Isopropylidene-3-O-mesyl-α-D-glucofuranose
C13H22O8S     相似度:61.5%
Molecules          2000          5          1386-1398
Study of Stereoselectivity in Organometallic Additions to 1, 2-O-Isopropylidene-O-R-α-D-xylopentodialdo-1, 4-furanose
Tibor Gracza and Peter Szolcsányi
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




6 .     1,2:3,4-di-O-isopropylidene-6-O-(prop-2-ynyloxy)-D-galactopyranose
    相似度:60%
Heterocycles          2005          65          1035-1049
Cu(I)-catalyzed Formation of D-Mannofuranosyl 1,4-Disubstituted 1,2,3-Triazolecarbohybrids
Penny L. Miner, Timothy R. Wagner, and Peter Norris*
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




7 .     3-O-acetyl-1,2:5,6-di-O-isopropylidene-β-L-mannofuranose
    相似度:58.3%
Tetrahedron Letters          2000          41          3119-3122
Efficient synthesis of L-altrose and L-mannose
Shang-Cheng Hung, Cheng-Chung Wang, Shankar R. Thopate
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




8 .     1,2:4,5-Di-O-isopropylidene-β-D-erythro-2,3-hexodiulo-2,6-pyranose
    相似度:58.3%
Archives of Pharmacal Research          1986          9          229-232
Oxidation of carbohydrates and a carbon-13 n.m.r. study of the keto sugars
Seung-Ho An
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




9 .     1D-2,5-di-azido-2,5-di-deoxy-1,6;3,4-di-O-isopropylidene-allo-inositol
C12H18N6O4     相似度:58.3%
Tetrahedron Letters          2004          45          8367-8370
Efficient routes to optically active azido-, amino-, di-azido- and di-amino-cyclitols with chiro- and allo-configuration from myo-inositol
Kana M. Sureshan, Kyoko Ikeda, Naoki Asano, Yutaka Watanabe
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




10 .     2,2':5,6-Di-O-isopropylidene-2-C-hydroxymethyl-D-galactono-1,4-lactone
C13H20O7     相似度:58.3%
Tetrahedron Letters          2005          46          5755-5759
Kiliani reactions on ketoses: branched carbohydrate building blocks from D-tagatose and D-psicose
Raquel Soengas, Ken Izumori, Michela Iezzi Simone, David J. Watkin, Ulla P. Skytte, Wim Soetaert, George W.J. Fleet
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




11 .     2,2':5,6-Di-O-isopropylidene-2-C-hydroxymethyl-D-altrono-1,4-lactone
C13H20O7     相似度:58.3%
Tetrahedron Letters          2005          46          5755-5759
Kiliani reactions on ketoses: branched carbohydrate building blocks from D-tagatose and D-psicose
Raquel Soengas, Ken Izumori, Michela Iezzi Simone, David J. Watkin, Ulla P. Skytte, Wim Soetaert, George W.J. Fleet
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




12 .     5-O-Allyl-1,2-O-isopropylidene-D-fructopyranose
C12H20O6     相似度:58.3%
Bioorganic & Medicinal Chemistry          2000          8          1825-1833
Synthesis and evaluation of fructose analogues as inhibitors of the d-fructose transporter GLUT5
Arnaud Tatibouët, Jing Yang, Christophe Morin, Geoffrey D. Holman
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




13 .     1,2:5.6-di-O-isopropylidene-3-O-allyl-α-D-glucofuranose
C15H24O6     相似度:57.1%
Indian Journal of Chemistry          2007          46B          1648-1657
A carbohydrate-based synthesis of fused bicyclic ethers by radical cyclization of epoxides using titanocene(III) chloride
Jana,S; Guin,C; Roy,S C
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




14 .     compound 11a
C18H34O6Si     相似度:56.2%
Zeitschrift für Naturforschung B          2005          60          962-966
Efficient and Rapid Regioselective Deprotection of Isopropylidene Ketals
S. M. Mahalingam and I. S. Aidhen
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




15 .     compound 3
    相似度:54.5%
Journal of Natural Products          1999          62          383-385
Halogenated Monoterpenes from Plocamium costatum and Their Biological Activity1
Gabriele M. König, Anthony D. Wright, and Rocky de Nys
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




16 .     (2S,5S)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-iodomethyl-1,4-dioxane
C10H17IO4     相似度:54.5%
Molecules          2008          13          2962-2974
Enantioselective Synthesis of Homo-N-Nucleosides Containing a 1, 4-Dioxane Sugar Analog
Qiang Yu and Per Carlsen
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




17 .     3,7-dimethyl-oct-1-ene-3,6,7-triol
    相似度:54.5%
Phytochemistry          1995          39          1115-1118
Linalool and cineole type glucosides from Cunila spicata
Detlef Manns
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




18 .     (R,S)-and (S)-1,2-O-Isopropylidene-4-O-benzylbutane-1,2,4-triol
    相似度:54.5%
Journal of Natural Products          1999          62          35-40
Isolation, Identification, and Enantioselective Synthesis of Octane-1,3,7-trioletermination of Its Absolute Configuration
Till Beuerle, Sonja Engelhard, Carlo Bicchi, and Wilfried Schwab
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




19 .     5-O-(tert-butyldiphenylsilyl)-1'-(benzenesulfonylmethylene)-2',3'-O-isopropylidene-α-D-ribofuranose
C31H38O7SSi     相似度:54.5%
Journal of Heterocyclic Chemistry          2003          40          317-320
New approach to l'C-modified riboside scaffold via stereoselective functionalization of D-(+)-ribonic-y-lactone
Arnaldo Alzérreca
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




20 .     compound 7
    相似度:54.5%
Tetrahedron Letters          2004          45          4759-4762
Silica supported MoO3: a mild heterogeneous catalyst for the Beckmann rearrangement and its application to some sugar derived ketoximes
Mohan K. Dongare, Vivekanand V. Bhagwat, C.V. Ramana, Mukund K. Gurjar
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




21 .     compound 3
C11H15N3O4     相似度:54.5%
Tetrahedron Letters          2005          46          4585-4588
Expedient synthesis of 1,2,3-triazole-fused tetracyclic compounds by intramolecular Huisgen (‘click’) reactions on carbohydrate-derived azido-alkynes
Srinivas Hotha, Ramakrishna I. Anegundi, Arvind A. Natu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




22 .     compound 4d
    相似度:54.5%
Tetrahedron Letters          2005          46          4753-4756
The synthesis and catalytic application of spacer-modified diol-functionalised Merrifield resins
Philip W. Dyer, Sandeep Handa, Toby B. Reeve, Samuel Suhard
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




23 .     (3S)-1,2-epoxy-6-methoxyirid-8-en-7-ol
C11H18O3     相似度:54.5%
Tetrahedron          1996          52          3921-3932
Total synthesis of optically active cotylenol, a fungal metabolite having a leaf growth activity. Intramolecular ene reaction for an eight-membered ring formation
Nobuo Kato, Hiroaki Okamoto, Hitoshi Takeshita
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




24 .     3,4-O-isopropylidene-2-O-methanesulfonyl-β-D-arabinopyranosyl chloride
    相似度:54.5%
Tetrahedron          2004          60          5225-5235
A total synthesis of (+)-oxybiotin from d-arabinose
Velimir Popsavin, Goran Benedeković, Mirjana Popsavin, Vladimir Divjaković, Thomas Armbruster
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




25 .     isobutyl 2,2-dimethyl-1,3-dioxolan-4-yl acetate
    相似度:54.5%
The Journal of Organic Chemistry          2010          75          8508-8515
Isolation, Structural Assignment, and Total Synthesis of Barmumycin
Adriana Lorente, Daniel Pla, Librada M. Canedo, Fernando Albericio, and Mercedes Alvarez
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




26 .     6-vinyl-3α-hydroxy-2,2,6α-trimethyltetrahydropyran
    相似度:54.5%
Russian Journal of Organic Chemistry          2002          38          498-506
Rearrangements of Epoxides of Linalool and Nerolidyl Acetate in Acid Media
T. M. Khomenko, L. E. Tatarova, D. V. Korchagina and V. A. Barkhash
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




27 .     (3aR,6S,7aR)-2,2-dimethyl-6-[(p-tolyl)sulfonyl]tetrahydro-4H-thiopyrano[3,4-d]-[1,3]dioxole
C15H20O4S2     相似度:53.8%
Journal of Heterocyclic Chemistry          2001          38          579-584
Concise synthesis of 6-sulfonylated 3,4-dihydro-2h-thiopyrans and 7-sulfonylated 3,4,5,6-tetrahydrothiepines from lactols
John K. Gallos and Constantinos C. Dellios
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




28 .     compound 7
C13H19NO7     相似度:53.8%
Tetrahedron Letters          2002          43          3961-3962
Intramolecular carbene and nitrene insertions at C-2 of diacetone-D-glucose
Daniel F. Berndt, Peter Norris
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




29 .     2-C-hydroxymethyl-2,2':5,6-di-O-isopropylidene-D-glucono-1,4-lactone
    相似度:53.8%
Tetrahedron Letters          2004          45          9461-9464
Kiliani on ketoses: branched carbohydrate building blocks from d-fructose and l-sorbose
David Hotchkiss, Raquel Soengas, Michela Iezzi Simone, Jeroen van Ameijde, Stuart Hunter, Andrew R. Cowley, George W.J. Fleet
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------




30 .     compound 1
    相似度:53.8%
Tetrahedron Letters          2004          45          9143-9145
Addition of secondary phosphines to a vinyl ether of diacetone-d-glucose: a new approach to optically active phosphines and their derivatives
Boris A. Trofimov, Boris G. Sukhov, Svetlana F. Malysheva, Natal’ya A. Belogorlova, Anatolii P. Tantsirev, Lidiya N. Parshina, Ludmila A. Oparina, Sergey P. Tunik, Nina K. Gusarova
Structure      13C NMR   碳谱模拟图
2楼2012-06-13 09:30:23
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