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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

化合物碳谱数据如下,溶剂是氘代甲醇
15.86, 15.88, 17.03, 17.99, 19.22, 23.98, 27.32, 28.53, 31.58, 31.62, 31.64, 33.03, 37.78, 37.92, 40.23, 41.06, 43.85, 48.13, 53.42, 57.27, 62.22, 62.42, 70.76, 71.69, 74.63, 76.19, 76.22, 77.45, 77.54, 78.96, 84.05, 89.78, 91.52, 104.46, 106.17, 106.97, 125.21, 142.88, 172.09, 216.84
谢谢了噢!
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audreygc

铁杆木虫 (正式写手)

【答案】应助回帖

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感谢参与,应助指数 +1
yjl2007: 金币+10 2013-05-24 14:12:13
查询结果:共查到475个化合物(查询结果仅供参考)  
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1 .     philoxeroideside D
C42H64O14     相似度:71.4%
Journal of Asian Natural Products Research          2009          11          261-266
Cytotoxic triterpene saponins from Alternanthera philoxeroides
Jin-Bo Fang , Zhi Yao , Jia-Chun Chen , Yan-Wen Liu , Yoshihisa Takaishi and Hong-Quan Duana
Structure      13C NMR   碳谱模拟图

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2 .     pentandroside D
C39H64O13     相似度:67.5%
Phytochemistry          2004          65          2935-2945
Steroidal saponins from the aerial parts of Tribulus pentandrus Forssk
Arafa I. Hamed, Wieslaw Oleszek , Anna Stochmal, Cosimo Pizza, Sonia Piacente
Structure      13C NMR   碳谱模拟图

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3 .     Leonticin I
C63H100O30     相似度:66.6%
Fitoterapia          2010          81          897-901
New triterpenoid saponins from Leontice smirnowii
Nino Tabatadze, Sok-Siya Bun, Badri Tabidze, Vakhtang Mshvildadze, Genri Dekanosidze, Evelyne Ollivier, Riad Elias
Structure      13C NMR   碳谱模拟图

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4 .     3β-O-β-D-glucopyranosyl-(1→2)-α-L-arabinopyranosylurs-12-en-28-oic acid
C41H66O12     相似度:65.8%
Journal of Agricultural and Food Chemistry          2002          50          255-261
Studies on the Constituents of a Brazilian Folk Infusion. Isolation and Structure Elucidation of New Triterpene Saponins from Ilex amara Leaves
Fabio Donisete Pezzuto de Andrade, Sonia Piacente, Cosimo Pizza, and Wagner Vilegas
Structure      13C NMR   碳谱模拟图

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5 .     3β-O-β-D-glucopyranosyl-(1→2)-α-L-O-arabinopyranosylurs-12-en-28-oic acid
C41H66O12     相似度:65.8%
Journal of Agricultural and Food Chemistry          2002          50          255-261
Studies on the Constituents of a Brazilian Folk Infusion. Isolation and Structure Elucidation of New Triterpene Saponins from Ilex amara Leaves
Fabio Donisete Pezzuto de Andrade, Sonia Piacente, Cosimo Pizza, and Wagner Vilegas
Structure      13C NMR   碳谱模拟图

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6 .     ilexsaponin B1
    相似度:65.8%
Lishizhen Medicine and Materia Medica Research          2010          21          2002-2004
Chemical Constituents of Ilex pubescens
ZENG Xian-yi; LI Yu-yun; XU Xiao-yan; LI Huo-ru; WU Di; LI Yan; WANG Li-jing
Structure      13C NMR   碳谱模拟图

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7 .     nudicaucin A
    相似度:65.1%
Phytochemistry          1998          48          525-528
Triterpenoid saponins from Hedyotis nudicaulis
Masataka Konishi, Yoshio Hano, Mitsuo Takayama, Taro Nomura, Ahmad Sazali Hamzah, Rohaya bte Ahmad, Halila Jasmani
Structure      13C NMR   碳谱模拟图

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8 .     spinasaponin A methyl ester
C43H68O14     相似度:65.1%
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

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9 .     28-O-β-D-Glucopyranosylbetulinic acid 3β-O-β-D-glucopyranoside
C42H68O13     相似度:64.2%
Journal of Natural Products          2009          72          72-81
Synthesis and Cytotoxicity of Bidesmosidic Betulin and Betulinic Acid Saponins
Charles Gauthier,Jean Legault,Serge Lavoie, Simon Rondeau, Samuel Tremblay, and André Pichette
Structure      13C NMR   碳谱模拟图

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10 .     depressoside C
C42H68O13     相似度:64.2%
Chemical & Pharmaceutical Bulletin          2000          48(11)          1597-1601
Novel Cycloartane Saponins from Corchorus depressus L.
Viqar Uddin AHMAD,Akbar ALI,Zulfiqar ALI,Farah Naz ZAFAR and Muhammad ZAHID
Structure      13C NMR   碳谱模拟图

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11 .     randianin
    相似度:64.2%
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

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12 .     ryobusaponin E
C42H66O14     相似度:64.2%
Chemical & Pharmaceutical Bulletin          2013          69          134-143
Triterpene Saponins from Clethra barbinervis and Their Hyaluronidase Inhibitory Activities
Toshihiro Murata, Atsushi Suzuki, Nagisa Mafune, Eriko Sato, Toshio Miyase, Fumihiko Yoshizaki
Structure      13C NMR   碳谱模拟图

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13 .     3-O-Cellobiosyl-cochalic acid
C42H68O14     相似度:64.2%
Journal of Agricultural and Food Chemistry          2010          58          5509-5514
New Resistance-Correlated Saponins from the Insect-Resistant Crucifer Barbarea vulgaris
Nikoline J. Nielsen, John Nielsen and Dan Staerk
Structure      13C NMR   碳谱模拟图

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14 .     3-O-[β-D-glucuronopyranosyl]-30-O-[β-D-glucopyranosyl] 2,3,30-trihydroxyolean-12-en-28-oic acid
C42H66O16     相似度:64.2%
Journal of Agricultural and Food Chemistry          2009          57          2826-2835
New Triterpenic Saponins from the Aerial Parts of Medicago arabica (L.) Huds
Aldo Tava, Mariella Mella, Pinarosa Avato, Elisa Biazzi, Luciano Pecetti, Zbigniew Bialy and Marian Jurzysta
Structure      13C NMR   碳谱模拟图

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15 .     3β-O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosylurs-12-en-28-oic acid
C42H68O13     相似度:64.2%
Journal of Agricultural and Food Chemistry          2002          50          255-261
Studies on the Constituents of a Brazilian Folk Infusion. Isolation and Structure Elucidation of New Triterpene Saponins from Ilex amara Leaves
Fabio Donisete Pezzuto de Andrade, Sonia Piacente, Cosimo Pizza, and Wagner Vilegas
Structure      13C NMR   碳谱模拟图

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16 .     3β-O-β-D-glucopyranosyl-(1→2)-β-D-O-galactopyranosylurs-12-en-28-oic acid
C42H68O13     相似度:64.2%
Journal of Agricultural and Food Chemistry          2002          50          255-261
Studies on the Constituents of a Brazilian Folk Infusion. Isolation and Structure Elucidation of New Triterpene Saponins from Ilex amara Leaves
Fabio Donisete Pezzuto de Andrade, Sonia Piacente, Cosimo Pizza, and Wagner Vilegas
Structure      13C NMR   碳谱模拟图

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17 .     oblonganoside D
C41H64O12     相似度:63.4%
Chemical & Pharmaceutical Bulletin          2007          55(3)          422-427
Six New Triterpenoid Saponins from the Leaves of Ilex oblonga and Their Inhibitory Activities against TMV Replication
Zu-Jian WU,Ming-An OUYANG,Cong-Zhou WANG,and Zheng-Kun ZHANG
Structure      13C NMR   碳谱模拟图

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18 .     cincholic acid 3β-O-β-D-glucopyranosyl-(1→4)-β-D-fucopyranoside
C42H66O14     相似度:63.4%
Chemical & Pharmaceutical Bulletin          2004          52(10)          1258-1261
New Oleanan-Type Triterpene and Cincholic Acid Glycosides from Peruvian “Uña de Gato” (Uncaria tomentosa)
Mariko KITAJIMA,Ken-ichiro HASHIMOTO, Manuel SANDOVAL,Norio AIMI,andHiromitsu TAKAYAMA
Structure      13C NMR   碳谱模拟图

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19 .     zygophyloside K
C42H66O15     相似度:63.4%
Phytochemistry          1998          48          875-880
Triterpenoid saponins from Zygophyllum decumbens
Karl Pöllmann, Katja Schaller, Ulrich Schweizer, M. Hani A. Elgamal, Kamel H. Shaker, Karlheinz Seifert
Structure      13C NMR   碳谱模拟图

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20 .     oblonganoside L
C41H66O13     相似度:63.4%
Journal of Agricultural and Food Chemistry          2007          55          1712-1717
Anti-Tobacco Mosaic Virus (TMV) Triterpenoid Saponins from the Leaves of Ilex oblonga
Zu-Jian Wu, Ming-An Ouyang, Cong-Zhou Wang, Zheng-Kun Zhang, and Jian-Guo Shen
Structure      13C NMR   碳谱模拟图
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