求助如下化合物信息,感激不激。
化合物E-A14:
13.86,14.01,20.67,21.97,24.72,28.41,28.81,28.94,30.59,30.87,33.84,34.13,48.53,55.96,57.04,59.66,61.81,79.1,99.46,102.03,105.36,108.37,120.15,120.39,121.38,123.46,126.77,130.64,143.68,147.71,149.78,150.32,170.23
化合物TW-9-4:
14.48,18.89,21.15,26.82,31.06,49.03,55.73,56.52,57.54,60.23,62.36,79.55,102.52,105.89,108.87,120.64,120.88,121.9,123.99,127.29,131.13,133.52,137.99,144.21,145.84,148.17,150.32,150.86,170.87
化合物:TWE-1
14.61,23.83,28.35,32.88,57.36,57.84,61.74,62.72,79.6,103.83,106.7,109.55,121.67,122.03,123.5,124.67,128.29,132.04,135.35,146.52,147.17,150.1,152.2
化合物E-A14
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
13.86,14.01,20.67,21.97,24.72,28.41,28.81,28.94,30.59,30.87,33.84,34.13,48.53,55.96,57.04,59.66,61.81,79.1,99.46,102.03,105.36,108.37,120.15,120.39,121.38,123.46,126.77,130.64,143.68,147.71,149.78,150.32,170.23
溶剂选项: 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值
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10个化合物(查询结果仅供参考)
--------------------------------------------------------------------------------
1 . 9-lauroylberberrubine
C31H38NO5 相似度:60.6%
Planta Medica 2000 66 361-363
Antimicrobial Activity of 9-O-Acyl-and 9-O-Benzoyl-Substituted Berberrubines
Sa Weon Hong,Sung Han Kim,Jung Ae Jeun ,Sang Jun Lee,Sung Uk Kim,Jung Han Kim
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
2 . N1-((7-Methoxybenzo[d][1,3]dioxol-5-yl)methyl)-N9-(1,2,3,4-tetrahydroacridin-9-yl)nonane-1,9-diamine
C31H41N3O3 相似度:54.5%
Bioorganic & Medicinal Chemistry 2011 19 763-770
Design, synthesis and evaluation of novel tacrine-multialkoxybenzene hybrids as dual inhibitors for cholinesterases and amyloid beta aggregation
Wen Luo, Yan-Ping Li, Yan He, Shi-Liang Huang, Jia-Heng Tan, Tian-Miao Ou, Ding Li, Lian-Quan Gu,Zhi-Shu Huang
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
3 . (6R,12aR)-6-(1,3-benzodioxol-5-yl)-2-octyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrdo[3,4-b]indol-1,4-dione
相似度:54.5%
Chemical & Pharmaceutical Bulletin 2009 57 185-189
Isolation and Structural Elucidation of Cyclopentynafil and N-Octylnortadalafil Found in a Dietary Supplement
Takashi Hasegawa, Kazunaga Takahashi, Masaaki Saijo, Toshiyasu Ishii, Tomoko Nagata, Masaaki Kurihara, Yuji Haishima, Yukihiro Goda and Nobuo Kawahara
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
4 . 17β-(pyridin-3-ylmethylidenehydrazinocarbonyl)-3-hydroxylup-20(29)-ene
C36H53O2N3 相似度:52.7%
Chemistry of Natural Compounds 2011 47 752-758
Conjugates of several lupane, oleanane, and ursane triterpenoids with the antituberculosis drug isoniazid and pyridinecarboxaldehydes
O. B. Kazakova, N. I. Medvedeva, I. A. Samoilova, I. P. Baikova and G. A. Tolstikov, et al.
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
5 . 3,4-seco-8(14→13R)abeo-17,13-friedo-4(28),7,14,24-lanostatetraen-26,23-olide-23-hydroxy-3-oate
C32H46O5 相似度:51.5%
Chemical & Pharmaceutical Bulletin 2008 56(9) 1352-1354
Rearranged Lanostane Triterpenoids from Abies sachalinensis (III)
Hui Yuan GAO,Li Jun WU,Takahisa NAKANE,Osamu SHIROTA,and Masanori KUROYANAGI
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
6 . 23,24(S)-dimethylcholest-5,22-dien-3β,7R-diol-3,7-diacetate
C33H52O4 相似度:51.5%
Journal of Natural Products 1999 62 785-786
An Unusual Novel C29 Steroid from the Soft Coral Lobophytum crassum1
M. Rama Rao, U. Venkatesham, M. Venkata Rami Reddy, and Y. Venkateswarlu
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
7 . compound 27
C34H39NO5 相似度:51.5%
Bioorganic & Medicinal Chemistry 2010 18 6734-6741
Fluorescent schweinfurthin B and F analogs with anti-proliferative activity
Joseph J. Topczewski, Craig H. Kuder, Jeffrey D. Neighbors, Raymond J. Hohl, David F. Wiemer
Structure 13C NMR 碳谱模拟图
-------------------------------------------------------------------------------- 11 1 2 3 4 5 6 下一页 尾页
化合物E-A14:
13.86,14.01,20.67,21.97,24.72,28.41,28.81,28.94,30.59,30.87,33.84,34.13,48.53,55.96,57.04,59.66,61.81,79.1,99.46,102.03,105.36,108.37,120.15,120.39,121.38,123.46,126.77,130.64,143.68,147.71,149.78,150.32,170.23
化合物TW-9-4:
14.48,18.89,21.15,26.82,31.06,49.03,55.73,56.52,57.54,60.23,62.36,79.55,102.52,105.89,108.87,120.64,120.88,121.9,123.99,127.29,131.13,133.52,137.99,144.21,145.84,148.17,150.32,150.86,170.87
化合物:TWE-1
14.61,23.83,28.35,32.88,57.36,57.84,61.74,62.72,79.6,103.83,106.7,109.55,121.67,122.03,123.5,124.67,128.29,132.04,135.35,146.52,147.17,150.1,152.2
化合物E-A14
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
13.86,14.01,20.67,21.97,24.72,28.41,28.81,28.94,30.59,30.87,33.84,34.13,48.53,55.96,57.04,59.66,61.81,79.1,99.46,102.03,105.36,108.37,120.15,120.39,121.38,123.46,126.77,130.64,143.68,147.71,149.78,150.32,170.23
溶剂选项: 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O (CH3)4Si C4D8O2 CD3COOD C4D8O2 H2O D2O CF3COOD CD3OD ND3 CD3COCD3 C6D6 CD3CN 查询空值
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10个化合物(查询结果仅供参考)
--------------------------------------------------------------------------------
1 . 9-lauroylberberrubine
C31H38NO5 相似度:60.6%
Planta Medica 2000 66 361-363
Antimicrobial Activity of 9-O-Acyl-and 9-O-Benzoyl-Substituted Berberrubines
Sa Weon Hong,Sung Han Kim,Jung Ae Jeun ,Sang Jun Lee,Sung Uk Kim,Jung Han Kim
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
2 . N1-((7-Methoxybenzo[d][1,3]dioxol-5-yl)methyl)-N9-(1,2,3,4-tetrahydroacridin-9-yl)nonane-1,9-diamine
C31H41N3O3 相似度:54.5%
Bioorganic & Medicinal Chemistry 2011 19 763-770
Design, synthesis and evaluation of novel tacrine-multialkoxybenzene hybrids as dual inhibitors for cholinesterases and amyloid beta aggregation
Wen Luo, Yan-Ping Li, Yan He, Shi-Liang Huang, Jia-Heng Tan, Tian-Miao Ou, Ding Li, Lian-Quan Gu,Zhi-Shu Huang
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
3 . (6R,12aR)-6-(1,3-benzodioxol-5-yl)-2-octyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrdo[3,4-b]indol-1,4-dione
相似度:54.5%
Chemical & Pharmaceutical Bulletin 2009 57 185-189
Isolation and Structural Elucidation of Cyclopentynafil and N-Octylnortadalafil Found in a Dietary Supplement
Takashi Hasegawa, Kazunaga Takahashi, Masaaki Saijo, Toshiyasu Ishii, Tomoko Nagata, Masaaki Kurihara, Yuji Haishima, Yukihiro Goda and Nobuo Kawahara
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
4 . 17β-(pyridin-3-ylmethylidenehydrazinocarbonyl)-3-hydroxylup-20(29)-ene
C36H53O2N3 相似度:52.7%
Chemistry of Natural Compounds 2011 47 752-758
Conjugates of several lupane, oleanane, and ursane triterpenoids with the antituberculosis drug isoniazid and pyridinecarboxaldehydes
O. B. Kazakova, N. I. Medvedeva, I. A. Samoilova, I. P. Baikova and G. A. Tolstikov, et al.
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
5 . 3,4-seco-8(14→13R)abeo-17,13-friedo-4(28),7,14,24-lanostatetraen-26,23-olide-23-hydroxy-3-oate
C32H46O5 相似度:51.5%
Chemical & Pharmaceutical Bulletin 2008 56(9) 1352-1354
Rearranged Lanostane Triterpenoids from Abies sachalinensis (III)
Hui Yuan GAO,Li Jun WU,Takahisa NAKANE,Osamu SHIROTA,and Masanori KUROYANAGI
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
6 . 23,24(S)-dimethylcholest-5,22-dien-3β,7R-diol-3,7-diacetate
C33H52O4 相似度:51.5%
Journal of Natural Products 1999 62 785-786
An Unusual Novel C29 Steroid from the Soft Coral Lobophytum crassum1
M. Rama Rao, U. Venkatesham, M. Venkata Rami Reddy, and Y. Venkateswarlu
Structure 13C NMR 碳谱模拟图
--------------------------------------------------------------------------------
7 . compound 27
C34H39NO5 相似度:51.5%
Bioorganic & Medicinal Chemistry 2010 18 6734-6741
Fluorescent schweinfurthin B and F analogs with anti-proliferative activity
Joseph J. Topczewski, Craig H. Kuder, Jeffrey D. Neighbors, Raymond J. Hohl, David F. Wiemer
Structure 13C NMR 碳谱模拟图
-------------------------------------------------------------------------------- 11 1 2 3 4 5 6 下一页 尾页