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zhiwu1983

木虫 (正式写手)

[求助] 求助微谱数据

碳谱数据如下:18.2,19.7,21.4,25.2,25.3,27.9,36.2,41.4,44.3,50.1,55.1,58.1,59.6,67.9,68.3,75.8,102.3,170.2,217.3
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wangkaibo123

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kerry

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【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
zhiwu1983: 金币+15, ★★★★★最佳答案 2013-12-08 14:56:32
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

溶剂选项:
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222个化合物(查询结果仅供参考)
1 .     17-Hydroxy-16-hydroxyiminobayeran-19-oic acid
C21H33NO4     相似度:60%
Phytochemistry          2008          69          1528-1533
Plant growth regulation activity of steviol and derivatives
Brás Heleno de Oliveira, Júlio César Stiirmer, José D. de Souza Filho,Ricardo Antonio Ayub
Structure      13C NMR   碳谱模拟图
2 .     davisinol
C20H27NO2     相似度:60%
Journal of Natural Products          1996          59          360-366
Diterpenoid Alkaloids from Delphinium davisii
Ayhan Ulubelen
Structure      13C NMR   碳谱模拟图
3 .     davisinol
C20H27NO2     相似度:60%
Chemistry of Natural Compounds          2000          36          419-477
HETISANE-TYPE DITERPENOID ALKALOIDS
I. A. Bessonova and Sh. A. Saidkhodzhaeva
Structure      13C NMR   碳谱模拟图
4 .     isodojaponin C
C24H32O8     相似度:58.3%
Journal of Natural Products          2008          71(6)          1055-1058
ent-Kaurane Diterpenoids from Isodon japonicus
Seong Su Hong, Seon A. Lee, Xiang Hua Han, Ji Sang Hwang, Chul Lee,Dongho Lee, Jin Tae Hong, Youngsoo Kim, Heesoon Lee, and Bang Yeon Hwang
Structure      13C NMR   碳谱模拟图
5 .     11β,13-Epoxy-8β-acetoxy-α-cyclocostunolide
    相似度:57.8%
Phytochemistry          1986          25          1231-1233
11,13-oxygenated-sesquiterpene lactones from bartlettina karwinskiana
Feng Gao, Mahmut Miski, Tom J. Mabry
Structure      13C NMR   碳谱模拟图
6 .     compound 10b
    相似度:57.8%
Bioorganic & Medicinal Chemistry          1998          6          993-1002
Cross-linking of proteins by maillard processes—Model reactions of d-glucose or methylglyoxal with butylamine and guanidine derivatives
Markus O Lederer, Fränzi Gerum, Theodor Severin
Structure      13C NMR   碳谱模拟图
7 .     perforenyl acetate
    相似度:57.8%
Tetrahedron          2002          58          6749-6755
Halogenated sesquiterpenes from the red alga Laurencia obtusa
Dimitra Iliopoulou, Vassilios Roussis, Christophe Pannecouque, Erik De Clercq, Constantinos Vagias
Structure      13C NMR   碳谱模拟图
8 .     compound 19 methyl quaternary ammonium salt
C21H40INO5Si     相似度:57.8%
Tetrahedron          2013          69          5431-5437
PIDA-promoted intramolecular transannular aziridination to synthesize bridged azatricyclic amines related to methyllycaconitine
Zhi-Gang Liu, Hang Cheng, Meng-Jia Ge, Liang Xu, Feng-Peng Wang
Structure      13C NMR   碳谱模拟图
9 .     coetsoidin C
C21H30O5     相似度:57.1%
Phytochemistry          1989          28          2753-2757
Diterpenoids from Rabdosia coetsoides
Hao Huang,Yunlong Xu,Handong Sun
Structure      13C NMR   碳谱模拟图
10 .     Abbeokutone 17-O-acetate
    相似度:57.1%
Phytochemistry          1984          23          1055-1058
Guaianolides and heliangolides from Hymenopappus newberryi
F. Bohlmann, C. Zdero, B.L. Turner
Structure      13C NMR   碳谱模拟图
11 .     (6α )-6,18-dihydroxysclareol
C20H36O4     相似度:55%
Chemistry & Biodiversity          2006          Vol. 3          54
Structure Elucidation and Antibacterial Activity of New Fungal Metabolites of Sclareol
M. Iqbal Choudhary, Zafar Ali Siddiqui, Samreen Hussain, and Atta-ur-Rahman
Structure      13C NMR   碳谱模拟图
12 .     ent-kaurane-2β,3α,16α-triol
C20H34O3     相似度:55%
Helvetica Chimica Acta          2007          Vol. 90          1781
A New ent-Kaurane Diterpene from Stems of Alibertia macrophylla K. Schum. (Rubiaceae)
Viviane Caˆndida da Silva, Andréia de Oliveira Faria, Vanderlan da Silva Bolzani, and Márcia Nasser Lopes
Structure      13C NMR   碳谱模拟图
13 .     15-methoxypinusolidic acid
C21H30O5     相似度:55%
Chemical & Pharmaceutical Bulletin          2002          50(6)          834-836
A New Neuroprotective Pinusolide Derivative from the Leaves of Biota orientalis
Kyung Ah KOO, Sang Hyun SUNG, and Young Choong KIM
Structure      13C NMR   碳谱模拟图
14 .     agallochin H
C20H30O3     相似度:55%
Journal of Natural Products          2002          65          382-385
ent-Kaurane and Beyerane Diterpenoids from Excoecaria agallocha1
Ammanamanchi S. R. Anjaneyulu, Vadali Lakshmana Rao, and Karanam Sreedhar
Structure      13C NMR   碳谱模拟图
15 .     13-epi-homoverrucosan-5β,6β-diol-8-one
C20H32O3     相似度:55%
Phytochemistry          1995          40          199-203
13-Epi-homoverrucosane derivatives and other diterpenes from Plagiochila (hepaticae)
Susanne Valcic, Volker Huch, Michael Veith, Hans Becker
Structure      13C NMR   碳谱模拟图
Domyallbesttohaveahappylife.
2楼2013-12-08 13:23:28
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笑多会怀孕

铁杆木虫 (著名写手)

【答案】应助回帖

感谢参与,应助指数 +1
查询结果:共查到222个化合物(查询结果仅供参考)
1 .     17-Hydroxy-16-hydroxyiminobayeran-19-oic acid
C21H33NO4     相似度:60%
Phytochemistry          2008          69          1528-1533
Plant growth regulation activity of steviol and derivatives
Brás Heleno de Oliveira, Júlio César Stiirmer, José D. de Souza Filho,Ricardo Antonio Ayub
Structure      13C NMR   碳谱模拟图
2 .     davisinol
C20H27NO2     相似度:60%
Journal of Natural Products          1996          59          360-366
Diterpenoid Alkaloids from Delphinium davisii
Ayhan Ulubelen
Structure      13C NMR   碳谱模拟图
3 .     davisinol
C20H27NO2     相似度:60%
Chemistry of Natural Compounds          2000          36          419-477
HETISANE-TYPE DITERPENOID ALKALOIDS
I. A. Bessonova and Sh. A. Saidkhodzhaeva
Structure      13C NMR   碳谱模拟图
4 .     isodojaponin C
C24H32O8     相似度:58.3%
Journal of Natural Products          2008          71(6)          1055-1058
ent-Kaurane Diterpenoids from Isodon japonicus
Seong Su Hong, Seon A. Lee, Xiang Hua Han, Ji Sang Hwang, Chul Lee,Dongho Lee, Jin Tae Hong, Youngsoo Kim, Heesoon Lee, and Bang Yeon Hwang
Structure      13C NMR   碳谱模拟图
5 .     11β,13-Epoxy-8β-acetoxy-α-cyclocostunolide
    相似度:57.8%
Phytochemistry          1986          25          1231-1233
11,13-oxygenated-sesquiterpene lactones from bartlettina karwinskiana
Feng Gao, Mahmut Miski, Tom J. Mabry
Structure      13C NMR   碳谱模拟图
6 .     compound 10b
    相似度:57.8%
Bioorganic & Medicinal Chemistry          1998          6          993-1002
Cross-linking of proteins by maillard processes—Model reactions of d-glucose or methylglyoxal with butylamine and guanidine derivatives
Markus O Lederer, Fränzi Gerum, Theodor Severin
Structure      13C NMR   碳谱模拟图
7 .     perforenyl acetate
    相似度:57.8%
Tetrahedron          2002          58          6749-6755
Halogenated sesquiterpenes from the red alga Laurencia obtusa
Dimitra Iliopoulou, Vassilios Roussis, Christophe Pannecouque, Erik De Clercq, Constantinos Vagias
Structure      13C NMR   碳谱模拟图
8 .     compound 19 methyl quaternary ammonium salt
C21H40INO5Si     相似度:57.8%
Tetrahedron          2013          69          5431-5437
PIDA-promoted intramolecular transannular aziridination to synthesize bridged azatricyclic amines related to methyllycaconitine
Zhi-Gang Liu, Hang Cheng, Meng-Jia Ge, Liang Xu, Feng-Peng Wang
Structure      13C NMR   碳谱模拟图
9 .     coetsoidin C
C21H30O5     相似度:57.1%
Phytochemistry          1989          28          2753-2757
Diterpenoids from Rabdosia coetsoides
Hao Huang,Yunlong Xu,Handong Sun
Structure      13C NMR   碳谱模拟图
10 .     Abbeokutone 17-O-acetate
    相似度:57.1%
Phytochemistry          1984          23          1055-1058
Guaianolides and heliangolides from Hymenopappus newberryi
F. Bohlmann, C. Zdero, B.L. Turner
Structure      13C NMR   碳谱模拟图
11 .     (6α )-6,18-dihydroxysclareol
C20H36O4     相似度:55%
Chemistry & Biodiversity          2006          Vol. 3          54
Structure Elucidation and Antibacterial Activity of New Fungal Metabolites of Sclareol
M. Iqbal Choudhary, Zafar Ali Siddiqui, Samreen Hussain, and Atta-ur-Rahman
Structure      13C NMR   碳谱模拟图
12 .     ent-kaurane-2β,3α,16α-triol
C20H34O3     相似度:55%
Helvetica Chimica Acta          2007          Vol. 90          1781
A New ent-Kaurane Diterpene from Stems of Alibertia macrophylla K. Schum. (Rubiaceae)
Viviane Caˆndida da Silva, Andréia de Oliveira Faria, Vanderlan da Silva Bolzani, and Márcia Nasser Lopes
Structure      13C NMR   碳谱模拟图
13 .     15-methoxypinusolidic acid
C21H30O5     相似度:55%
Chemical & Pharmaceutical Bulletin          2002          50(6)          834-836
A New Neuroprotective Pinusolide Derivative from the Leaves of Biota orientalis
Kyung Ah KOO, Sang Hyun SUNG, and Young Choong KIM
Structure      13C NMR   碳谱模拟图
3楼2013-12-08 13:23:34
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