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xf890529

木虫 (小有名气)

[求助] 求助微谱数据,谢谢

溶剂为氘代氯仿21.28,22.99,27.47,28.96,29.79,30.01,45.29,48.13,50.78,55.84,59.50,68.50,
69.52,83.67,99.94,111.70,113.67,120.10,121.90,122.02,133.40,137.16,157.69,158.84,165.67,166.13,171.97
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ivyasspring

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xf890529: 金币+8, ★★★★★最佳答案 2013-04-27 08:46:48
1 .     18-oxotryprostatin A
C22H25N3O4     相似度:55.5%
Journal of Natural Products          2008          71(6)          985-989
Cytotoxic Alkaloids and Antibiotic Nordammarane Triterpenoids from the Marine-Derived Fungus Aspergillus sydowi
Min Zhang, Wen-Liang Wang, Yu-Chun Fang, Tian-Jiao Zhu, Qian-Qun Gu, and Wei-Ming Zhu
Structure      13C NMR   碳谱模拟图

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2 .     compound 6
C27H33N3O6     相似度:55.5%
Tetrahedron          2008          64          7986-7991
Seven new prenylated indole diketopiperazine alkaloids from holothurian-derived fungus Aspergillus fumigatus
Fazuo Wang, Yuchun Fang, Tianjiao Zhu, Min Zhang, Aiqun Lin, Qianqun Gu, Weiming Zhu
Structure      13C NMR   碳谱模拟图

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3 .     12,13-dihydroxyfumitremorgin C
C22H25N3O5     相似度:51.8%
Chemistry of Natural Compounds          2004          40          615-617
FUMITREMORGINS FROM THE MARINE ISOLATE OF THE FUNGUS Aspergillus fumigatus
Sh. Sh. Afiyatullov, A. I. Kalinovskii, M. V. Pivkin,P. S. Dmitrenok, and T. A. Kuznetsova
Structure      13C NMR   碳谱模拟图

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4 .     Diethyl [(17β-hydroxy-3-methoxy-estra-1,3,5(10)-trien-16β-ylamino)methylene]malonate
C27H37NO6     相似度:51.8%
Steroids          2002          67          835-849
Synthesis, structure and catechol-oxidase activity of copper(II) complexes of 17-hydroxy-16-(N-3-oxo-prop-1-enyl)amino steroids
Rainer Wegner, Manuela Dubs, Helmar Görls, Christian Robl, Bruno Schönecker, Ernst-G. Jäger
Structure      13C NMR   碳谱模拟图

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5 .     16α-Toluene-p-sulfonyloxymethyl-3-methoxy-13α-estra-1,3,5(10)-trien-17β-ol
C27H34O5S     相似度:51.8%
Steroids          2003          68          451-458
Stereoselective halogenation of the 16-hydroxymethyl-3-methoxy-13α-estra-1,3,5(10)-trien-17-ols and their solvolytic investigation
János Wölfling, Erzsébet Mernyák, Péter Forgó, Gyula Schneider
Structure      13C NMR   碳谱模拟图

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6 .     16α-toluenep-sulfonyloxymethyl-3-methoxy-13 -estra-1,3,5(10)-trien-17 -acetate 3i
    相似度:51.8%
Steroids          2003          68          451-458
Stereoselective halogenation of the 16-hydroxymethyl-3-methoxy-13α-estra-1,3,5(10)-trien-17-ols and their solvolytic investigation
János Wölfling, Erzsébet Mernyák, Péter Forgó, Gyula Schneider
Structure      13C NMR   碳谱模拟图

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

7 .     acetyl-hobartidiol
    相似度:51.8%
Journal of Natural Products          1990          Vol 53          713
Alcaloïdes Indoliques Isoles d'Aristotelia australasica
J. C. Quirion, C. Kan, H. P. Husson, I. R. C. Bick
Structure      13C NMR   碳谱模拟图

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8 .     10,11-dihydroxy-fumitremorgin C
C23H21N5O4     相似度:51.8%
Phytochemistry          1990          29          1025-1026
12,13-Dihydroxy-fumitremorgin C from Aspergillus fumigatus
Wolf-Rainer Abraham,Hans-Adolf Arfmann
Structure      13C NMR   碳谱模拟图

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9 .     compound 11
    相似度:51.8%
Steroids          1994          59          305-309
Synthesis of new 16-spirosteroids
Lutz F. Tietze, János Wölfling, Gyula Schneider, Mathias Noltemeyer
Structure      13C NMR   碳谱模拟图

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10 .     Xylogranatin F
C26H27NO6     相似度:51.8%
Chemistry-A European Journal          2008          14          1129-1144
Xylogranatins F–R: Antifeedants from the Chinese Mangrove, Xylocarpus granatum, A New Biogenetic Pathway to Tetranortriterpenoids
Jun Wu, Si Zhang, Torsten Bruhn, Qiang Xiao, Haixin Ding and Gerhard Bringmann
Structure      13C NMR   碳谱模拟图

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11 .     Nα-(tert-butyloxycarbonyl)-(R)-tryptophan di-n-pentylamide
    相似度:51.8%
Journal of Medicinal Chemistry          1991          34          3350-3359
Cholecystokinin (CCK) antagonists: (R)-tryptophan-based hybrid antagonists of high affinity and selectivity for CCK-A receptors
James F. Kerwin Jr., Frank Wagenaar, Hana Kopecka, Chun Wel Lin, Thomas Miller, David Witte, Michael Stashko, Alex M. Nadzan
Structure      13C NMR   碳谱模拟图

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12 .     [4-(tetradecyloxy)phenyl]methylacetyl(2-pyridinylmethyl)carbamate
C30H44N2O4     相似度:51.8%
Journal of Medicinal Chemistry          1993          36          580-590
Analogs of platelet activating factor. 8. Antagonists of PAF containing an aromatic ring linked to a pyridinium ring
Michael P. Trova, Allan Wissner, Marion L. Carroll, Suresh S. Kerwar, Walter C. Pickett, Robert E. Schaub, Lawrence W. Torley, Constance A. Kohler
Structure      13C NMR   碳谱模拟图

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13 .     tricarbonyl[ethyl (η4-4,5,6,7)-(2E,4E,6E)-5-(3-indolyl)methyl-7-(2,6,6-trimethyl-1-cyclo-hexen-1-yl)-2,4,6-heptatrienoate]iron
C30H33FeNO5     相似度:50%
Journal of Heterocyclic Chemistry          2001          38          259-264
Synthesis of 11Z-9-demethyl-9-((3-indolyl)methyl)retinal
Akimori Wada, Naoko Fujioka and Masayoshi Ito
Structure      13C NMR   碳谱模拟图

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14 .     compound 12h
    相似度:50%
Bioorganic & Medicinal Chemistry          1998          6          2029-2039
New 1α,25-dihydroxy vitamin D3 analogues with side chains attached to C-18: synthesis and biological activity
Gunnar Grue-Sørensen, Christina Mørk Hansen
Structure      13C NMR   碳谱模拟图

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15 .     (2S,4S,5S,7S)-5-Azido-N-(3-amino-2,2-dimethylpropyl)-4-hydroxy-2-isopropyl-7-(4-methoxy-3-(3-methoxypropoxy) benzyl)-8-methylnonanamide
C30H52N7O5     相似度:50%
Bioorganic & Medicinal Chemistry          2011          19          4238-4249
Synthesis, biological evaluation and docking studies of octane-carboxamide based renin inhibitors with extended segments toward S3' site of renin
Yong Wu, Chen Shi, Xiaowei Sun, Xiaoming Wu, Hongbin Sun
Structure      13C NMR   碳谱模拟图

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

16 .     (2S,4S,5S,7S)-5-Azido-N-(2,2-dimethyl-3-(2,2,2-trifluor oacetamido)propyl)-4-hydroxy-2-isopropyl-7-(4-methoxy-3-(3-methoxypropoxy)benzyl)-8-methylnonanamide
C32H52N5O6F3     相似度:50%
Bioorganic & Medicinal Chemistry          2011          19          4238-4249
Synthesis, biological evaluation and docking studies of octane-carboxamide based renin inhibitors with extended segments toward S3' site of renin
Yong Wu, Chen Shi, Xiaowei Sun, Xiaoming Wu, Hongbin Sun
Structure      13C NMR   碳谱模拟图

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

17 .     Ethyl (3-((2S,4S,5S,7S)-5-Azido-4-hydroxy-2-isopropyl-7-(4-methoxy-3-(3-methoxypropoxy)benzyl)-8-methyl nonanamido)-2,2-dimethylpropyl)carbamate
C33H57N5O7     相似度:50%
Bioorganic & Medicinal Chemistry          2011          19          4238-4249
Synthesis, biological evaluation and docking studies of octane-carboxamide based renin inhibitors with extended segments toward S3' site of renin
Yong Wu, Chen Shi, Xiaowei Sun, Xiaoming Wu, Hongbin Sun
Structure      13C NMR   碳谱模拟图

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

18 .     (2S,4S,5S,7S)-5-Azido-N-(3-(3,3-dimethylureido)-2,2-dimethylpropyl)-4-hydroxy-2-isopropyl-7-(4-methoxy-3-(3-methoxypropoxy)benzyl)-8-methylnonanamide
C33H58N6O6     相似度:50%
Bioorganic & Medicinal Chemistry          2011          19          4238-4249
Synthesis, biological evaluation and docking studies of octane-carboxamide based renin inhibitors with extended segments toward S3' site of renin
Yong Wu, Chen Shi, Xiaowei Sun, Xiaoming Wu, Hongbin Sun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------
2楼2013-04-26 09:16:53
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