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zxjun

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[求助] 帮忙查下微谱

碳谱数据:26.3, 28.1, 29.1, 38.6, 39.1, 40.1, 64.6, 70.6, 71.8, 75.0, 75.4, 77.9, 104.5, 114.9, 115.2, 116.5, 123.0, 127.7, 128.9, 128.9, 129.0, 146.8, 147.2, 149.6, 169.1, 222.0
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jackey5460

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吉祥二宝

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
26.3,28.1,29.1,38.6,39.1,40.1,64.6,70.6,71.8,75.0,75.4,77.9,104.5,114.9,115.2,116.5,123.0,127.7,128.9,128.9,129.0,146.8,147.2,149.6,169.1,222.0
  
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332个化合物(查询结果仅供参考)  
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1 .     (1′R,5′R)-5-(5-carboxymethyl-2-oxocyclopentyl)-3Z-pentenyl β-D-(6-O-galloyl)glucopyranoside
C25H32O13     相似度:69.2%
Journal of Natural Products          2008          71(5)          861-865
Phenolic Glycosides from Berries of Pimenta dioica
Hiroe Kikuzaki, Yoshiko Miyajima, and Nobuji Nakatani
Structure      13C NMR   碳谱模拟图

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2 .     6''-O-[(E)-caffeoyl] rengyoside B
C23H30O11     相似度:69.2%
Helvetica Chimica Acta          2009          92          1070-1079
Chemical Constituents from Clerodendrum bungei and Their Cytotoxic Activities
Shan-Shan Liu, Tong Zhou, Shu-Wei Zhang, Li-Jiang Xuan
Structure      13C NMR   碳谱模拟图

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3 .     Calceolarioside D
C23H26O11     相似度:69.2%
Phytochemistry          1993          33          137-139
A quinol glucoside from Abeliophyllum distichum
Hiroshi Kuwajima, Mika Takahashi, Mami Ito, Wu Hua-Xin, Kiyokazu Takaishi, Kenichiro Inoue
Structure      13C NMR   碳谱模拟图

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4 .     dracunculifoside K
C25H28O11     相似度:61.5%
Chemical & Pharmaceutical Bulletin          2002          50(5)          583-589
Studies on the Constituents from the Aerial Part of Baccharis dracunculifolia DC. II
Yoshimi NAGATANI, Tsutomu WARASHINA, and Tadataka NORO
Structure      13C NMR   碳谱模拟图

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5 .     dracunculifoside P
C26H36O13     相似度:61.5%
Chemical & Pharmaceutical Bulletin          2002          50(5)          583-589
Studies on the Constituents from the Aerial Part of Baccharis dracunculifolia DC. II
Yoshimi NAGATANI, Tsutomu WARASHINA, and Tadataka NORO
Structure      13C NMR   碳谱模拟图

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6 .     1'-O-chlorogenoylchlorogenic acid
    相似度:61.5%
Planta Medica          2001          67          732-736
Isolation from Cussonia barteri of 1'-O-Chlorogenoylchlorogenic Acid and 1'-O-Chlorogenoylneochlorogenic Acid, a New Type of Quinic Acid Esters
S. Papajewski, B. Vogler1, J. Conrad, I. Klaiber, G. Roos, C. U. Walter, R. Süûmuth, W. Kraus
Structure      13C NMR   碳谱模拟图

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7 .     vitexfolin A
C25H28O11     相似度:61.5%
Chemical & Pharmaceutical Bulletin          1998          46          655-662
Pharmacologically Active Components of Viticis Fructus (Vitex rotundifolia). II. The Component Having Analgesic Effects
Emi OKUYAMA,Shigeru FUJIMORI,Mikio YAMAZAKI and Takeshi DEYAMA
Structure      13C NMR   碳谱模拟图

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8 .     calceolarioside B
    相似度:61.5%
Phytochemistry          1994          37          441-443
Three phenylethanoid glucosides of unusual structure from Chirita sinensis (gesneriaceae)
Søren Damtoft, Søren Rosendal Jensen
Structure      13C NMR   碳谱模拟图

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9 .     grayanin
C23H23NO9     相似度:61.5%
Phytochemistry          1987          26          2363-2366
Cyanogenic and phenylpropanoid glucosides from Prunus grayana
Hiroko Shimomura,Yutaka Sashida,Tokuo Adachi
Structure      13C NMR   碳谱模拟图

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10 .     grayanin
C23H23NO9     相似度:61.5%
Phytochemistry          1987          26          2363-2366
Cyanogenic and phenylpropanoid glucosides from Prunus grayana
Hiroko Shimomura,Yutaka Sashida,Tokuo Adachi
Structure      13C NMR   碳谱模拟图

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11 .     calceolarioside D
C23H26O11     相似度:61.5%
Phytochemistry          1988          27          639-641
Phenylpropanoid glycosides from Calceolaria hypericina
M. Nicoletti,C. Galeffi,I. Messana,G.B. Marini-Bettolo,J.A. Garbarino,V. Gambaro
Structure      13C NMR   碳谱模拟图

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12 .     3,4-dihydroxyphenethyl alcohol-6-O-caffeoyl-β-D-glucoside
    相似度:61.5%
Phytochemistry          1990          29          3627-3631
Phenolic compounds from Plantago asiatica
Helle Ravn,Sansei Nishibe,Michiko Sasahara,Li Xuebo
Structure      13C NMR   碳谱模拟图

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13 .     2-(4-hydroxypheny)ethyl-[6-O-(E)-caffeoryl]-β-D-glucopyranoside
C23H26O10     相似度:61.5%
Phytochemical Analysis          2009          20          353-364
NMR and UPLC-qTOF-MS/MS characterisation of novel phenylethanol derivatives of phenylpropanoid glucosides from the leaves of strawberry (Fragaria × ananassa cv. Jonsok)
Kati Hanhineva, Pasi Soininen, Mikko J. Anttonen, Harri Kokko, Ilana Rogachev, Asaph Aharoni, Reino Laatikainen and Sirpa Krenlampi
Structure      13C NMR   碳谱模拟图

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14 .     calceolarioside B
    相似度:61.5%
Chinese Pharmaceutical Journal          2009          44          490-492
Studies on Chemical Constituents in Forsythia suspensa (Thunb.) Vahl
FENG Wei-sheng, LI Ke-ke, ZHENG Xiao-ke
Structure      13C NMR   碳谱模拟图

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15 .     3,4-dihydroxyphenethyl-(6'-caffeoy l)-β-D-glucoside
    相似度:61.5%
Chinese Pharmaceutical Journal          2011          46          259-262
Chemical Constituents from the Fruits of Ligustrum lucidum
FENG Zhi-yi, FENG Jing, CUI Ying
Structure      13C NMR   碳谱模拟图

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16 .     2-(4-hydroxyphenyl)-ethyl-(6-O-caffeoyl)-β-D-glucopyranoside
C23H26O10     相似度:61.5%
Chinese Journal of Medicinal Chemistry          2007          17          242-245
Phenolic constituents from Stauntonia chinensis DC.
YANG Lei, GAO Hao, WANG Nai-li, YAO Xin-sheng
Structure      13C NMR   碳谱模拟图

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17 .     hebitol II
    相似度:61.5%
Journal of Natural Products          2011          74          1477-1483
Iridoid and Phenylethanoid Glucosides from Veronica lavaudiana
Rilka M. Taskova, Tetsuo Kokubun, Ken G. Ryan, Phil J. Garnock-Jones, and Søren R. Jensen
Structure      13C NMR   碳谱模拟图

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18 .     6'-O-caffeoylcatalpol
C24H28O13     相似度:61.5%
Journal of Natural Products          2011          74          1477-1483
Iridoid and Phenylethanoid Glucosides from Veronica lavaudiana
Rilka M. Taskova, Tetsuo Kokubun, Ken G. Ryan, Phil J. Garnock-Jones, and Søren R. Jensen
Structure      13C NMR   碳谱模拟图

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19 .     dracunculifoside L
C28H30O13     相似度:60.7%
Chemical & Pharmaceutical Bulletin          2002          50(5)          583-589
Studies on the Constituents from the Aerial Part of Baccharis dracunculifolia DC. II
Yoshimi NAGATANI, Tsutomu WARASHINA, and Tadataka NORO
Structure      13C NMR   碳谱模拟图

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20 .     dracunculifoside O
C28H34O13     相似度:60.7%
Chemical & Pharmaceutical Bulletin          2002          50(5)          583-589
Studies on the Constituents from the Aerial Part of Baccharis dracunculifolia DC. II
Yoshimi NAGATANI, Tsutomu WARASHINA, and Tadataka NORO
Structure      13C NMR   碳谱模拟图

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21 .     dracunculifoside A
C28H40O11     相似度:60.7%
Chemical & Pharmaceutical Bulletin          2001          49(11)          1388-1394
Studies on the Constituents from the Aerial Part of Baccharis dracunculifolia DC.
Yoshimi NAGATANI, Tsutomu WARASHINA, and Tadataka NORO
Structure      13C NMR   碳谱模拟图

1 .     (1′R,5′R)-5-(5-carboxymethyl-2-oxocyclopentyl)-3Z-pentenyl β-D-(6-O-galloyl)glucopyranoside

2楼2012-01-06 22:55:03
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