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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:
16.9, 17.7, 18.7, 20.2, 24.8, 24.9, 25.4, 27.1, 27.8, 29.3, 29.7, 31.6, 32.4, 34.1, 34.3, 35.7, 38.7, 40.6, 41.2, 41.5, 43.3, 43.7, 48.0, 51.2, 57.8, 62.7, 63.7, 69.8, 70.2, 71.4, 71.7, 72.2, 72.3, 72.5, 73.0, 73.2, 74.5, 74.6, 76.1, 76.7, 76.9, 77.5, 77.6, 78.7, 78.8, 79.0, 79.8, 80.3, 92.0, 96.5, 103.7, 105.0, 105.5, 106.2, 124.6, 145.6, 178.8
谢谢。
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lifeliuyan

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【答案】应助回帖

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yjl2007: 金币+10 2013-11-06 20:55:04
查询结果:共查到3459个化合物(查询结果仅供参考)  
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1 .     pastuchoside D
C59H96O26     相似度:89.8%
Chemical & Pharmaceutical Bulletin          2004          52(12)          1411-1415
Triterpenoid Saponins from Leaves of Hedera pastuchowii
Vakhtang MSHVILDADZE,Riad ELIAS, Robert FAURE,David RONDEAU,Laurent DEBRAUWER,Genri DEKANOSIDZE, Ether KEMERTELIDZE,and Guy BALANSARD
Structure      13C NMR   碳谱模拟图

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2 .     helixoside B
C54H88O23     相似度:87.7%
Phytochemistry          2000          53          905-909
Triterpene saponins from the fruits of Hedera helix
E. Bedir, H. Kırmızıpekmez, O. Sticher, İ.Çalış
Structure      13C NMR   碳谱模拟图

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3 .     saponin Pj-3
     相似度:86.4%
Chinese Traditional and Herbal Drugs          2004          35          495-498
三叶木通藤茎的化学成分研究
王晔,鲁静,林瑞超
Structure      13C NMR   碳谱模拟图

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4 .     3-O-β-D-吡喃葡萄糖-(1→2)-α-L-吡喃阿拉伯糖-齐墩果酸-28-O-α-L-吡喃鼠李糖-(1→4)-β-D-吡喃葡萄糖-(1→6)-β-D-吡喃葡萄糖酯苷
    相似度:84.7%
Chinese Traditional and Herbal Drugs          2004          35          495-498
三叶木通藤茎的化学成分研究
王晔,鲁静,林瑞超
Structure      13C NMR   碳谱模拟图

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


5 .     3-O-β-D-glucopyranosyl-(1→2)-α-L-arabinopyranosyl-echinocystic acid 28-O-α-L-rhamnopyranosyl-(1→4)-β-D-glucopyranosyl(1→6)-β-D-glucopyranoside
C59H96O27     相似度:84.7%
Journal of Agricultural and Food Chemistry          2001          49          5969-5974
Characterization of the Triterpene Saponins of the Roots and Rhizomes of Blue Cohosh (Caulophyllum Thalictroides)
Jin-Woo Jhoo, Shengmin Sang, Kan He, Xiaofang Cheng, Nanqun Zhu, Ruth E. Stark, Qun Yi Zheng, Robert T. Rosen, and Chi-Tang Ho
Structure      13C NMR   碳谱模拟图

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


6 .     3-O-(β-D-glucopyranosyl-(1-2)-β-D-glucopyranosyl)-28-O-(α-L-arabinopyranosyl(1-6)-β-D-glucopyranosyl)-oleanolic acid
C53H86O22     相似度:84.2%
Phytochemistry Letters          2012          5          188-193
Saponins and alkaloids from Abuta grandifolia
Charlotte Sayagh,Christophe Long,Christian Moretti,Catherine Lavaud
Structure      13C NMR   碳谱模拟图

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


7 .     3-O-(β-D-glucopyranosyl-(1-2)-β-D-glucopyranosyl)-28-O-(β-D-xylopyranosyl(1-6)-β-D-glucopyranosyl)-oleanolic acid
C53H86O22     相似度:84.2%
Phytochemistry Letters          2012          5          188-193
Saponins and alkaloids from Abuta grandifolia
Charlotte Sayagh,Christophe Long,Christian Moretti,Catherine Lavaud
Structure      13C NMR   碳谱模拟图

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


8 .     helianthoside 1
     相似度:83.6%
Planta Medica          1991          57          471-474
Neue Triterpensaponine aus Helianthus annuus New Triterpenoid Saponins from Helianthus annuus
Gerd Bader, Maureen Zieschang, Kathrin Wagner, Egon Gründemann und Karl Hiller
Structure      13C NMR   碳谱模拟图

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


9 .     pastuchoside E
C53H86O21     相似度:82.4%
Chemical & Pharmaceutical Bulletin          2004          52(12)          1411-1415
Triterpenoid Saponins from Leaves of Hedera pastuchowii
Vakhtang MSHVILDADZE,Riad ELIAS, Robert FAURE,David RONDEAU,Laurent DEBRAUWER,Genri DEKANOSIDZE, Ether KEMERTELIDZE,and Guy BALANSARD
Structure      13C NMR   碳谱模拟图

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


10 .     3-O-{β-D-ga1actopyranosyl-(1→3)[β-D-glucopyranosyl-(1→4)1-β-D-glucopyranosyl}oleanolic acid (28→1)-β-D-glucopyranosyl ester
     相似度:82.4%
Planta Medica          1991          57          250-253
Structure and in vitro Antiviral Activity of Triterpenoid Saponins from Calendula arvensis
Nunziatina De Tomniasi, Cinzia Conti, Maria Luisa Stein, and Cosimo Pizza
Structure      13C NMR   碳谱模拟图

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


11 .     3β-O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)-β-D-glucuronopyranosyl-oleanolic acid-28-O-β-D-glucopyranoside methyl ester
C55H88O24     相似度:82.4%
Biochemical Systematics and Ecology          2012          40          86-90
Triterpenoid saponins from Ferula hermonis Boiss
Zedan Z. Ibraheim, Wael M. Abdel-Mageed, Marcel Jaspars
Structure      13C NMR   碳谱模拟图

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


12 .     Sandrosaponin IX
C54H87O24     相似度:82.4%
Journal of Natural Products          2000          63          1479-1482
Four New Triterpenoid Saponins from the Roots of Bupleurum rigidum
Sandra Svnchez-Contreras, Ana María Dvaz-Lanza, and Manuel Bernabé
Structure      13C NMR   碳谱模拟图

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


13 .     guaiacin F
C53H86O22     相似度:82.4%
Phytochemistry          1990          29          3287-3290
Saponins from the leaves ofGuaiacum officinale
Viqar Uddin Ahmad,Shaista Perveen,Shaheen Bano
Structure      13C NMR   碳谱模拟图

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


14 .     stryphnoside B
C57H92O25     相似度:82.4%
Tetrahedron          2008          64          1474-1481
Stryphnosides A–F, six new triterpene glycosides from the pericarps of Stryphnodendron fissuratum
Akihito Yokosuka, Sachiko Kawakami, Mitsue Haraguchi, Yoshihiro Mimaki
Structure      13C NMR   碳谱模拟图

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


15 .     Sandrosaponin XI
C55H88O24     相似度:82.4%
Biochemical Systematics and Ecology          2012          40          86-90
Triterpenoid saponins from Ferula hermonis Boiss
Zedan Z. Ibraheim, Wael M. Abdel-Mageed, Marcel Jaspars
Structure      13C NMR   碳谱模拟图

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


16 .     Sweriyunnanoside B
C54H88O24     相似度:82.4%
Fitoterapia          2013          89          175-182
Chemical constituents of Swertia yunnanensis and their anti-hepatitis B virus activity
Tuan-Wu Cao, Chang-An Geng, Fu-Qiang Jiang, Yun-Bao Ma, Kang He, Ning-Jia Zhou, Xue-Mei Zhang, Jun Zhou, Ji-Jun Chen
Structure      13C NMR   碳谱模拟图

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


17 .     colchiside B
C60H96O27     相似度:81.6%
Chemical & Pharmaceutical Bulletin          2001          49(6)          752-754
Triterpenoid Saponins from Berries of Hedera colchica
Vakhtang MSHVILDADZE,Riad ELIAS,Robert FAURE,Laurent DEBRAUWER,Genri DEKANOSIDZE, Etheri KEMERTELIDZE,and Guy BALANSARD
Structure      13C NMR   碳谱模拟图

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


18 .     3β,22β,24-trihydroxy-olean-12-en 3-O-α-L-rhamnopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)-β-D-glucuronopyranosyl 22-O-β-D-glucopyranosyl-(1→2)-α-L-rhamnopyranoside
C60H98O27     相似度:81.6%
Phytochemistry Letters          2012          5          782-787
Oleanane glycosides from the roots of Alhagi maurorum
Arafa Hamed, Angela Perrone, Usama Mahalel, Wieslaw Oleszek, Anna Stochmal, Sonia Piacente
Structure      13C NMR   碳谱模拟图

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


19 .     cauloside G
C59H96O27     相似度:81.3%
Journal of Agricultural and Food Chemistry          2001          49          5969-5974
Characterization of the Triterpene Saponins of the Roots and Rhizomes of Blue Cohosh (Caulophyllum Thalictroides)
Jin-Woo Jhoo, Shengmin Sang, Kan He, Xiaofang Cheng, Nanqun Zhu, Ruth E. Stark, Qun Yi Zheng, Robert T. Rosen, and Chi-Tang Ho
Structure      13C NMR   碳谱模拟图
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