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yyllibra

木虫 (正式写手)

[求助] 求微谱数据

化合物1:
24.5,24.6,25.0,27.0,27.5,29.0,29.3,32.1,34.1,34.3,34.5,35.4,38.4,40.3,40.9,41.1,43.2,43.4,47.8,48.1,57.5,63.6,72.4,73.5,76.8,76.9,78.3,78.3,78.8,81.2,92.2,105.1,106.0,124.1,145.6,172.8,182.3
化合物2:
25.1,26.8,27.6,28.9,29.4,32.0,33.6,34.0,34.5,35.4,38.4,40.3,40.9,41.2,43.1,43.5,47.8,49.0,57.5,62.9,63.0,63.6,71.7,72.4,73.5,74.5,76.8,77.1,78.2,78.4,78.8,79.2,81.1,92.3,96.2,105.0,106.1,124.3,145.3,171.1,178.6
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yyllibra: 金币+100, ★★★★★最佳答案, 非常感谢~~~~ 2013-01-29 15:20:58
化合物1:
1 .     3-O-β-D-glucopyranosyl-(1→2)-β-D-glucuronopyranosyl-24-hydroxyoleanolic acid
C42H66O15     相似度:78.5%
Journal of Natural Products          2000          63          1261-1264
Triterpene Saponins, Quaternary Ammonium Compounds, Phosphatidyl Cholines, and Amino Acids in the Pronotal and Elytral Secretions of Platyphora opima and Desmogramma subtropica
V. Plasman, J. C. Braekman,D. Daloze, D. Windsor, and J. M. Pasteels
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     calenduloside E
C36H56O9     相似度:78.3%
China Journal of Chinese Materia Medica          2007          32          1138-1141
Studies on Chemical Constituents of Alternan theraphilox eroid es (Martl) Griseb
LUO Xiaoru, LI Bin, NIAN Jinxing, DONG Junxing
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     calenduloside E
C36H56O9     相似度:78.3%
Chinese Pharmaceutical Journal          2007          42          1138-1141
Studies on Chemical Constituents of Alternan theraphilox eroid es
LUO Xiao-ru, LI Bin, NIAN Jin-xing, DONG Jun-xing
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     pesudoginsenoside RP1 methyl ester
    相似度:76.1%
Bioorganic & Medicinal Chemistry Letters          2010          20          7110-7115
Oleanane-type triterpenoids from Panax stipuleanatus and their anticancer activities
Chun Liang, Yan Ding, Huu Tung Nguyen, Jeong-Ah Kim, Hye-Jin Boo, Hee-Kyoung Kang, Mahn Cuong Nguyen, Young Ho Kim
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     androseptoside A
    相似度:75.6%
Journal of Natural Products          2000          63          1461-1464
Bioactive Saponins from Swartzia schomburgkii from the Suriname Rainforest
Maged S. Abdel-Kader,Brian D. Bahler, Stan Malone,Marga C. M. Werkhoven, Jan H. Wisse,Kim M. Neddermann,Isia Bursuker,and David G. I. Kingston
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     oleanolic acid 3-O-β-D-glucuropyranoside
    相似度:75.6%
China Journal of Chinese Materia Medica          2009          34          2473-2476
Constituents from Alternanthera philoxeroides and their antitumor activity
FANG Jinbo, CHEN Jiachun, LIU Yanwen, DUAN Hongquan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     oleanolic acid 3-O-β-D-glucuronopyranoside-6'-O-methyl ester
    相似度:75.6%
China Journal of Chinese Materia Medica          2009          34          2473-2476
Constituents from Alternanthera philoxeroides and their antitumor activity
FANG Jinbo, CHEN Jiachun, LIU Yanwen, DUAN Hongquan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     oleanolic acid 3-O-β-D-glucuronopyranoside
    相似度:75.6%
Chinese Traditional and Herbal Drugs          2007          38          976-979
Antivirus constituents from Alternanthera philoxeroides
FANG Jin-bo; LIU Yan-wen; ZHANG Yan-wen; TENG Jie; DUAN Hong-quan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     randianin
    相似度:73.8%
Journal of Natural Products          2000          63          1461-1464
Bioactive Saponins from Swartzia schomburgkii from the Suriname Rainforest
Maged S. Abdel-Kader,Brian D. Bahler, Stan Malone,Marga C. M. Werkhoven, Jan H. Wisse,Kim M. Neddermann,Isia Bursuker,and David G. I. Kingston
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     3β-O-[β-D-galactopyranosyl-(1,3)-β-D-glucopyranosyl] oleanolic acid
C42H66O14     相似度:73.8%
Journal of Natural Products          1987          Vol 50          927
Plant Metabolites. Triterpenoid Saponins from Calendula arvensis
Cosimo Pizza, Zhou Zhong-Liang, Nunziatina de Tommasi
2楼2013-01-29 15:14:59
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化合物2:
1 .     chikusetsusaponin N a methyl ester
    相似度:79.0%
China Journal of Chinese Materia Medica          2009          34          2473-2476
Constituents from Alternanthera philoxeroides and their antitumor activity
FANG Jinbo, CHEN Jiachun, LIU Yanwen, DUAN Hongquan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     oleanolic acid 3-O-β-D-glucopyranosyl-glucopyranosyl-28-O-β-D-glucopyranoside
C42H68O13     相似度:78.5%
Journal of Agricultural and Food Chemistry          1998          46          1797-1804
Studies on the Constituents of Amaranthus caudatus Leaves:  Isolation and Structure Elucidation of New Triterpenoid Saponins and Ionol-Derived Glycosides
Luca Rastrelli, Rita Aquino, Susana Abdo, Maria Proto, Francesco De Simone, and Nunziatina De Tommasi
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     Hemslonin A
C42H68O13     相似度:76.1%
Acta Botanica Yunnanica          2003          25(2)          235-240
New Triterpenoid Glycosides from Hemsleya penxianensis var. gulinensis
LIN Yu-Ping,QIU Ming-Hua, LI Zhong-Rong,GAO Xu-Hong
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     28-O-β-D-glucopyranosyl-(1→6)-β-D-glucopyranoside
C42H68O13     相似度:76.1%
Chinese Chemical Letters          2003          14          169-172
Two New Compounds from Hemsleya penxianensis var. gulinensis
Yu Ping LIN, Ming Hua CHIU, Zhong Rong LI
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     chikusetsusaponin IVa
    相似度:76.1%
Bioorganic & Medicinal Chemistry Letters          2010          20          7110-7115
Oleanane-type triterpenoids from Panax stipuleanatus and their anticancer activities
Chun Liang, Yan Ding, Huu Tung Nguyen, Jeong-Ah Kim, Hye-Jin Boo, Hee-Kyoung Kang, Mahn Cuong Nguyen, Young Ho Kim
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     chikusetsusaponin Iva
    相似度:76.1%
Journal of Agricultural and Food Chemistry          1997          45          1027-1031
Saponins from Ilex dumosa, an Erva-maté (Ilex paraguariensis) Adulterating Plant
Viviane S. Pires, Dominique Guillaume, Grace Gosmann, and Eloir P. Schenkel
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     guaiacin B
C47H76O17     相似度:75.5%
Planta Medica          1989          55          307-308
Guaiacin A and B from the Leaves of Guaiacum officinale
Viqar Uddin Ahmad, Shaista Perveen, and Shaheen Bano
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     spinasaponin A methyl ester
C43H68O14     相似度:74.4%
Bioorganic & Medicinal Chemistry Letters          2010          20          7110-7115
Oleanane-type triterpenoids from Panax stipuleanatus and their anticancer activities
Chun Liang, Yan Ding, Huu Tung Nguyen, Jeong-Ah Kim, Hye-Jin Boo, Hee-Kyoung Kang, Mahn Cuong Nguyen, Young Ho Kim
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     3-O-[β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-α-L-arabinopyranosyl]-oleanolic acid
    相似度:73.9%
Journal of Natural Products          1993          Vol 56          329
A New Triterpene Glycoside from the Roots of Symphytum officinale
Viqar Uddin Ahmad, Mushtaq Noorwala, Faryal Vali Mohammad, Bilge Sener
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     Bifinoside A
C42H66O13     相似度:73.8%
Chemical & Pharmaceutical Bulletin          2011          59          1417-1420
Oleanolic Triterpene Saponins from the Roots of Panax bipinnatifidus
Nguyen Huu TUNG, Tran Hong QUANG, Nguyen Thi Thanh NGAN, Chau Van MINH, Bui Kim ANH, Pham Quoc LONG, Nguyen Manh CUONG, and Young Ho KIM
3楼2013-01-29 15:17:43
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