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myvalerie

至尊木虫 (正式写手)

[求助] 求助微谱数据库检索一化合物

16.10,16.75,18.31,19.76,22.31,23.62,25.12,25.71,27.22,28.20,30.40,32.45,
33.04,36.53,37.27,38.28,39.51,41.13,41.97,42.35,44.79,46.00,47.61,49.29,
55.71,64.34,76.33,80.35,122.25,143.71

模糊查询,相似度大于70%
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kaola0916

铁杆木虫 (著名写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
豆哥: 金币+2, 谢谢参与交流 2012-05-15 20:38:27
myvalerie: 金币+10, ★★★很有帮助, 多谢了! 2012-05-15 21:02:37
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
16.10,16.75,18.31,19.76,22.31,23.62,25.12,25.71,27.22,28.20,30.40,32.45,33.04,36.53,37.27,38.28,39.51,41.13,41.97,42.35,44.79,46.00,47.61,49.29,55.71,64.34,76.33,80.35,122.25,143.71
  
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815个化合物(查询结果仅供参考)  
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1 .     soyasapogenol
C30H50O3     相似度:96.6%
Acta Pharmaceutica Sinica          1993          28          116-121
STUDIES ON THE TRITERPENOIDS FROM ROOTS OF GLYCYRRHIZA SQUAMULOSA FROANCH
H Liang and RY Zhang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     Soyasapogenol B
C30H50O3     相似度:96.6%
Journal of Asian Natural Products Research          2005          7          237-243
Three new isoprenylated flavonoids from the roots of Sophora flavescens
PEI-LAN DING, AI-JUN HOU and DAO-FENG CHEN
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     Soyasapogenol B
    相似度:96.6%
Phytochemistry          1996          41          1573-1577
Triterpenoids from Melilotus messanensis; soyasapogenol G, the first natural carbonate derivative
Francisco A. Macías*, Ana M. Simonet, M. Dolores Esteban, Juan Carlos G. Galindo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     soyasapogenol B
    相似度:96.6%
Phytochemistry          1992          31          1773-1777
Saponins from Trifolium repens
Shiho Sakamoto, Sanae Kofuji, Masanori Kuroyanagi, Akira Ueno, Setsuko Sekita
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     soyasapogenol B
    相似度:96.6%
China Journal of Chinese Materia Medica          2010          35          607-609
Chemical constituents in Flos Sophorae Carbonisatus
LI Raorao*; WANG Caifang; LEI Peilin; HUANG Lanlan; YUAN Sitong
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     Soyasapogenol B
    相似度:96.6%
Chinese Journal of Medicinal Chemistry          2008          18          142-156
Chemical constituents of processed Astragalus membranaceus Bunge
LIU Wei, WANG Zhi-cheng, LIANG Fei-fei, LI Xian, WANG Jin-hui
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     12-oleanene-3,22,24-triol
    相似度:96.6%
Chinese Journal of Medicinal Chemistry          2010          20          201-205
Chemical constituents from themycelium of a new streptomycete
ZHENG Dan, JIANG Yi, HAN Li, LOU Kai, CHEN Yun, XU Li-hua, HUANG Xue-shi
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     soyasapogenol B
    相似度:96.6%
Journal of Shenyang Pharmaceutical University          2010          27          797-802
Isolation and identification of whole plant of chemical constituents from Trifolium repens L.
SUN Lin, LI Zhan-lin, PENG Jing-bo, HAN Guo-hua, HUA Hui-ming
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     soyasapogenin B
    相似度:96.6%
Russian Chemical Bulletin          2001          50          1107-1112
Secondary metabolites of Astragalus danicus Retz. and A. inopinatus Boriss.
A. S. Gromova, V. I. Lutsky, J. G. Cannon, D. Li and N. L. Owen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     soyasapogenol
    相似度:93.5%
Chinese Pharmaceutical Sciences          2005          14          75-78
Chemical Constituents of Hedysarum gmelinii
LIU Yi; MA Xiao-xia; CHEN Hu-biao; TU Guang-zhong; HE Jiu-ming; and ZHAO Yu-ying
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     soyasapogenol B
    相似度:93.3%
Journal of Natural Products          1990          Vol 53          298
Sapogenin Structure: Analysis of the 13C- and 1H-nmr Spectra of Soyasapogenol B
Robert L. Baxter, Keith R. Price, G. Roger Fenwick
Structure      13C NMR   碳谱模拟图
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12 .     myrioside C
C42H66     相似度:86.6%
Chemical & Pharmaceutical Bulletin          2002          50(8)          1097-1099
Five Triterpene Glycosides from Oxytropis myriophylla
Masafumi OKAWA,Rie YAMAGUCHI, Hurlad DELGER,Ryota TSUCHIHASHI, Toshihiro NOHARA,Junei KINJO, Susumu ISODA, and Yoshiteru IDA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     myrioside D
C47H74O19     相似度:86.6%
Chemical & Pharmaceutical Bulletin          2002          50(8)          1097-1099
Five Triterpene Glycosides from Oxytropis myriophylla
Masafumi OKAWA,Rie YAMAGUCHI, Hurlad DELGER,Ryota TSUCHIHASHI, Toshihiro NOHARA,Junei KINJO, Susumu ISODA, and Yoshiteru IDA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     soyasapogenol B
    相似度:86.6%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     soyasapogenol B
    相似度:86.6%
Phytochemistry          1991          30          3389-3393
Triterpenoid saponins from Medicago hispida
Sashi B. Mahato
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     azukisapogenol
    相似度:86.6%
Chemical Research in Chinese Universities          1988          4          39-43
Studies on the Chemical Constituents of Oxytropis Glabra DC(I)
Sun Rongqi,Jia Zongjian and Zhu Ziqing;Chen Nenyu and Zhao Fanzhi
Structure      13C NMR   碳谱模拟图
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17 .     3-O-[α-L-rhamnopyranosyl(1→2)-β-D-glucopyranosyl(1→4)-β-D-glucuronopyranosyl]-soyasapogenol B
    相似度:86.6%
Acta Chimica Sinica          1987          45          145-149
Studies on the Chemical Components of Oxtropis ochrocephala Bunge II. The Structures of Two Triterpenoid Saponins
Sun Rong-Qi Cheng Dong-Liang Jia Zhong-JianZhu Zi-Qing
Structure      13C NMR   碳谱模拟图
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18 .     soyasapogenol B
    相似度:83.3%
Planta Medica          1991          57          94-95
Phaseoluside-A, A New Soyasapogenol B Triglucoside from Phaseolus vulgaris Seeds
Dharam C. fain, PawanK Agrawal, and Raghunath S. Thakur
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     soyasapogenol A
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1995          43          1176-1179
Oleanene-Type Triterpene Glycosides from Puerariae Radix. II. Isolation of Saponins and the Application of Tandem Mass Spectrometry to Their Structure Determination
Tomonori ARAO,Junei KINJO,Toshihiro NOHARA and Ryuichi ISOBE
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     soyasapogenol A
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1994          42          1874-1878
Five New Triterpene Glycosides from Russell Lupine
Junei KINJO,Fumiko KISHIDA,Kazutaka WATANABE,Fumio HASHIMOTO and Toshihiro NOHARA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

21 .     soyasapogenol B
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1989          37          1550-1553
Studies on the Constituents of Leguminous Plants. XI. : The Structures of New Triterpenoids from Wistaria brachybotrys SIEB. et ZUCC.
Takao KONOSHIMA,Mutsuo KOZUKA,Mitsumasa HARUNA,Kazuo ITO and Takeatsu KIMURA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

22 .     soyasapogenol A
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1985          33          1293-1296
OLEANENE-SAPOGENOLS FROM PUERARIAE RADIX
Junei Kinjo,Izumi Miyamoto,Kotaro Murakami,Kiyoshi Kida,Toshiaki Tomimatsu,Masaki Yamasaki and Toshihiro Nohara
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

23 .     Soyasapogenol A
    相似度:83.3%
Chemistry of Natural Compounds          1992          28          1-23
13C NMR SPECTROSCOPY OF OLEANANE DERIVATIVES
A. I. Kalinovskii
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

24 .     3α,22β-dihydroxyolean-12-ene
C30H50O2     相似度:83.3%
Natural Product Research          2002          16          415-418
Alysinol - A New Triterpene from Alysicarpus Monolifer
Naheed Riaz; Itrat Anis; Pir Muhammad Khan; Raza Shah; Abdul Malik
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

25 .     soyasapogenol A
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1997          45          362-366
Oleanene-Type Triterpene Glycosides from Puerariae Radix. IV. Six New Saponins from Pueraria lobata
Tomonori ARAO,Junnei KINJO,Toshihiro NOHARA and Ryuichi ISOBE
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

26 .     Melilotigenin C
C30H48O3     相似度:83.3%
Phytochemistry          1998          49          709-717
Bioactive polar triterpenoids from Melilotus messanensis
Francisco A. Macías, Ana M. Simonet, Juan Carlos G. Galindo, Pedro C. Pacheco, Jose A. Sánchez
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

27 .     katonic acid
    相似度:83.3%
Journal of Natural Products          1992          Vol 55          654
Plant Anticancer Agents, L. Cytotoxic Triterpenes from Sandoricum koetjape Stems
Norito Kaneda, John M. Pezzuto, A. Douglas Kinghorn, Norman R. Farnsworth, Thawatchai Santisuk, Patoomratana Tuchinda, Jinda Udchachon, Vichai Reutrakul
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

28 .     soyasapogenol A
    相似度:83.3%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

29 .     olean-12-ene-1β-24-diol
C30H50O3     相似度:83.3%
Zeitschrift für Naturforschung B          2008          63b          101-104
Sigmoiside F and Propyloxyamyrin, Two New Triterpenoid Derivatives from Erythrina sigmoidea (Fabaceae)
Jacques Kouam, Alain L. Meli, Muhammad I. Choudhary, and Zacharias T. Fomum
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

30 .     soyasapogenol B
    相似度:83.3%
Chinese Traditional and Herbal Drugs          2010          41          187-190
Studies on chemical constituents of Oxytropis kansuensis
GONG Hong-fei; YANG Ai-mei; LIU Jun-xi; DI Duo-long
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

31 .     olean-12-en-3β,24-diol
    相似度:83.3%
Chinese Traditional and Herbal Drugs          2007          38          32-34
红车轴草的化学成分研究
索志新;斯建勇;沈连钢;王瑞虎
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

32 .     compound 10a
C44H62O3     相似度:81.2%
Chemical & Pharmaceutical Bulletin          1997          45          877-882
Medicinal Foodstuffs. VI. Histamine Release Inhibitors from Kidney Bean, the Seeds of Phaseolus vulgaris L : Chemical Structures of Sandosaponins A and B
Masayuki YOSHIKAWA,Hiromi SHIMADA,Hajime KOMATSU,Tetsuo SAKURAMA,Norihisa NISHIDA,Johji YAMAHARA,Hiroshi SHIMODA,Hisashi MATSUDA and Tadato TANI
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

33 .     A-homo-4-aza-3-oxoolean-12-en-30-oic acid methyl ester
C31H49O3N     相似度:80.6%
Chemistry of Natural Compounds          2009          45          519-521
BECKMANN REARRANGEMENT OF 11-DEOXO-GLYCYRRHETICACID 3-KETOXIME
L. R. Mikhailova, M. V. Khudobko,L. A. Baltina, Jr., and L. A. Baltina
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

34 .     oleanolic aldehyde acetate
    相似度:80.6%
Korean Journal of Pharmacognosy          2010          41          97-102
Inhibition of IL-6 Production in TNF-α Stimulated MG-63 by the Triterpenoids Isolated from Aucuba japonica
Qinglong Jin, Hong-Guang Jin, Ji Eun Shin, Eun Jin Choi and Eun-Rhan Woo
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

35 .     myrioside B
C36H56O10     相似度:80%
Chemical & Pharmaceutical Bulletin          2002          50(8)          1097-1099
Five Triterpene Glycosides from Oxytropis myriophylla
Masafumi OKAWA,Rie YAMAGUCHI, Hurlad DELGER,Ryota TSUCHIHASHI, Toshihiro NOHARA,Junei KINJO, Susumu ISODA, and Yoshiteru IDA
Structure      13C NMR   碳谱模拟图
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