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lqf327

铜虫 (正式写手)

[求助] 微谱求助,急啊!已有1人参与

化合物的碳谱如下:  137.9, 128.7, 76.1, 64.2, 63.8, 62.9, 55.1, 51.0, 47.7, 43.6, 40.0, 39.1, 37.1, 36.0, 31.8, 26.6, 21.9, 21.6, 18.2, 15.8

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月宫折桂

木虫 (正式写手)

【答案】应助回帖

感谢参与,应助指数 +1
查询结果:共查到9个化合物(查询结果仅供参考)
1 .     1,3-diaminohexane
C6H16N2     相似度:57.1%
Russian Journal of Organic Chemistry          2011          47          168-172
Catalytic synthesis of 1,3-propylenediamines
K. V. Yakovlev, D. V. Petrov, V. A. Dokichev and Yu. V. Tomilov
Structure      13C NMR   碳谱模拟图
2 .     6,4''-di-O-methylerythromycin B
C39H71NO12     相似度:57.1%
The Journal of Antibiotics          1990          43          544-549
CHEMICAL MODIFICATION OF ERYTHROMYCINS IV. SYNTHESIS AND BIOLOGICAL PROPERTIES OF 6-O-METHYLERYTHROMYCIN B
SHIGEO MORIMOTO, TAKASHI ADACHI, YOKO MISAWA, TAKATOSHI NAGATE, YOSHIAKI WATANABE, SADAFUMI OMURA
Structure      13C NMR   碳谱模拟图
3 .     compound 8
C7H11N3O5     相似度:57.1%
The Journal of Antibiotics          1982          35          1507-1512
γ1-N-ACYLATION OF GENTAMICIN C1a, BY A CYCLIC, CHIRAL γ-AMINO-α-HYDROXY ACID RELATED TO THE (S)-4-AMINO-2-HYDROXYBUTYRIC ACID
M. PHILIPPE, A. M. SEPULCHRE, S. D. GERO, H. LOIBNER, W. STREICHER, P. STUTZ
Structure      13C NMR   碳谱模拟图
4 .     N-(but-3-ynyl)methanesulfonamide
C5H9NO2S     相似度:57.1%
European Journal of Organic Chemistry          2010                   2304-2313
Broadening the Synthetic Scope of the Iron(III)-Catalyzed Aza-Prins Cyclization
Rubén M. Carballo, Guillermo Valdomir, Martín Purino, Víctor S. Martín and Juan I. Padrón
Structure      13C NMR   碳谱模拟图
5 .     compound 25
C7H15ON     相似度:57.1%
Magnetic Resonance in Chemistry          1986          24          480-492
Stereochemistry of nitrogen-containing heterocycles. IV—1H and 13C NMR spectra, ASIS effects, nitrogen inversion, configuration and conformations of substituted tetrahydro-1,3-oxazines
Yu. Yu. Samitov, O. I. Danilova, B. V. Unkovsky and I. P. Boiko
Structure      13C NMR   碳谱模拟图
6 .     compound 6
    相似度:50%
Phytochemistry          1987          26          3015-3020
Vebraside,an iridoid glucoside from Verbena brasiliensis
Adrian Franke,Horst Rimpler
Structure      13C NMR   碳谱模拟图
7 .     2'-methyl-3'-oxo-8-methyl-spiro{8-azabicyclo[3.2.1]octane-3,5'-isoxazolidine}
C11H18N2O2     相似度:50%
Bioorganic & Medicinal Chemistry          2012          20          6344-6355
A novel spirocyclic tropanyl-Δ2-isoxazoline derivative enhances citalopram and paroxetine binding to serotonin transporters as well as serotonin uptake
Clelia Dallanoce, Mara Canovi, Carlo Matera, Tiziana Mennini, Marco De Amici, Marco Gobbi, Carlo De Micheli
Structure      13C NMR   碳谱模拟图
8 .     3'-bromo-8-methyl-spiro{8-azabicyclo[3.2.1]octane-3,5'(4'H)-isoxazole} methyl iodide
C11H18BrIN2O     相似度:50%
Bioorganic & Medicinal Chemistry          2012          20          6344-6355
A novel spirocyclic tropanyl-Δ2-isoxazoline derivative enhances citalopram and paroxetine binding to serotonin transporters as well as serotonin uptake
Clelia Dallanoce, Mara Canovi, Carlo Matera, Tiziana Mennini, Marco De Amici, Marco Gobbi, Carlo De Micheli
Structure      13C NMR   碳谱模拟图
9 .     compound 29
    相似度:50%
Canadian Journal of Chemistry          1975          53          581-588
13C Nuclear Magnetic Resonance Studies. 45. The 13C Spectra of Some β,γ Unsaturated Polycyclic Ketones
J. B. Stothers, J. R. Swenson, C. T. Tan
Structure      13C NMR   碳谱模拟图
2楼2014-12-10 10:17:55
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月宫折桂

木虫 (正式写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★
lqf327: 金币+10, ★★★★★最佳答案 2014-12-10 17:30:46
不好意思,上面的是别人的数据。由于格式问题。通过从新调整,下边是你的数据
查询结果:共查到1468个化合物(查询结果仅供参考)
1 .     compound 3
    相似度:90%
Acta Pharmaceutica Sinica          1987          Vol 22          756-760
STUDIES ON BIOACTIVE CONSTITUENTS FROM THE EXCRETA OF TROGOPTERUS XANTHIPES MILNE-EDWARDS
YANG Dong-Ming; SU Shi-Wen; LI Xian and ZHU Ting-Ru
Structure      13C NMR   碳谱模拟图
2 .     kirenol
    相似度:90%
Journal of Shenyang Pharmaceutical University          2009          26          444-446
Isolation and identification of the chemical constituents from the whole plant of Siegesbeckia pubescens Makino
JIANG Lin, DING Huai-wei, SONG Shao-jiang
Structure      13C NMR   碳谱模拟图
3 .     wulingzhic acidv
C20H32O5     相似度:70%
Acta Pharmaceutica Sinica          1987          Vol 22          756-760
STUDIES ON BIOACTIVE CONSTITUENTS FROM THE EXCRETA OF TROGOPTERUS XANTHIPES MILNE-EDWARDS
YANG Dong-Ming; SU Shi-Wen; LI Xian and ZHU Ting-Ru
Structure      13C NMR   碳谱模拟图
4 .     farblose nadeln
C20H34O3     相似度:65%
Chemical & Pharmaceutical Bulletin          1983          31          4409-4416
Chemische und Chemotaxonomische Untersuchungen der Pterophyten. XLIV. Chemische Untersuchungen der Inhaltsstoffe von Microlepia marginata (PANZER) C. CHR. (2)
TADAYUKI KURAISHI,TAKAO TANIGUCHI,KAZUYUKI HORI,TAKAO MURAKAMI,NOBUTOSHI TANAKA,YASUHISA SAIKI and CHIUMING CHEN
Structure      13C NMR   碳谱模拟图
5 .     darutoside
    相似度:65%
China Journal of Chinese Materia Medica          2009          34          2754-2757
Chemical constituents of Siegesbeckia pubescens
OU Zhiqiang, ZHAO Lang, WANG Kan, FU Hongzheng
Structure      13C NMR   碳谱模拟图
6 .     (-)-isopimara-8(14),15-diene
    相似度:65%
Phytochemistry          1997          45          387-390
Parryin, a diterpene with a tricyclic 6-7-5-ring system from Salvia parryi
Elsa M. Guajardo Touche, Elda Gómez Loprz, Alfredo P. Reyes, Humberto Sánchez, Friedrich Honecker, Hans Achenbach
Structure      13C NMR   碳谱模拟图
7 .     compound 4
    相似度:65%
Acta Pharmaceutica Sinica          1987          Vol 22          756-760
STUDIES ON BIOACTIVE CONSTITUENTS FROM THE EXCRETA OF TROGOPTERUS XANTHIPES MILNE-EDWARDS
YANG Dong-Ming; SU Shi-Wen; LI Xian and ZHU Ting-Ru
Structure      13C NMR   碳谱模拟图
8 .     8(14),15-sandaracopimaradiene-2α,18-diol
    相似度:65%
Phytochemistry          1987          26          493-495
8(14),15-sandaracopimaradiene-2α,18-diol,a minor constituent of the rwandese medicinal plant Tetradenia riparia
Luc Van Puyvelde,Norbert De Kimpe,François Borremans,Weiguo Zhang,Niceas Schamp
Structure      13C NMR   碳谱模拟图
9 .     ent-7,19-dihydroxy-6,7-seco-kauran-6-oic acid 6→19-lactone
C20H32O3     相似度:65%
Phytochemistry          1988          27          761-765
7-hydroxy-6,7-seco-kaurenes as inhibitors of gibberellin biosynthesis in Gibberella fujikuroi
Mark K. Baynham,Julia M. Dickinson,James R. Hanson
Structure      13C NMR   碳谱模拟图
10 .     ent-Pimara-8(14),15-diene-19-ol
    相似度:65%
Archives of Pharmacal Research          2009          32          1399-1408
Cholinesterase and BACE1 inhibitory diterpenoids from Aralia cordata
Hyun Ah Jung, Eun Ju Lee, Ju Sun Kim, Sam Sik Kang and Je-Hyun Lee, et al.
Structure      13C NMR   碳谱模拟图
11 .     ent-pimarane diterpenoid alcohol
C20H32O     相似度:65%
Tetrahedron letters          1976          17          2451-2454
(−-thermarol, a new ent-pimarane-class diterpene diol from Jungermannia thermarum (liverwort)
Akihiko Matsuo, Seiryû Uto, Mitsuru Nakayama, Shûichi Hayashi, Kazuo Yamasaki, Ryoji Kasai, Osamu Tanaka
Structure      13C NMR   碳谱模拟图
12 .     compound 8
    相似度:65%
Natural Product Communications          2008          3          399-412
Structural Elucidation of Pimarane and IsopimaraneDiterpenoids: The 13C NMR Contribution
Ana M. L. Seca, Diana C. G. A. Pinto and Artur M. S. Silva
Structure      13C NMR   碳谱模拟图
13 .     15-nor-18-hydroxy-13-epi-manoyloxide-14-oicacid
C19H32O4     相似度:65%
Natural Product Communications          2008          3          877-880
Secondary Metabolites from the Aerial Parts ofSalvia aethiopis L.
Anna Malafronte, Fabrizio Dal Piaz, Giuseppina Cioffi , Alessandra Braca, Antonella Leoneand Nunziatina De Tommasi
Structure      13C NMR   碳谱模拟图
14 .     isopimara-8(14),15-diene
    相似度:65%
Chinese Traditional and Herbal Drugs          2011          42          432-436
Secondary metabolites of marine fungus Eutypella scoparia from the South China Sea and their antitumor activities
SUN Li, LI Dong-li, CHEN Yu-chan, TAO Mei-hua, DAN Fei-jun, ZHANG Wei-min
Structure      13C NMR   碳谱模拟图
15 .     5α-Androstan-15α-ol
C19H32O     相似度:65%
Organic Magnetic Resonance          1977          9          439-464
13C n.m.r. spectra of steroids —a survey and commentary
J. W. Blunt and J. B. Stothers
Structure      13C NMR   碳谱模拟图
16 .     compound 2
    相似度:65%
Acta Botanica Yunnanica          1984          6          219-222
THE ISOPIMARANE-TYPE DITERPENOID FROM FRUITS OF CARDIOCRINUM GIGANTEUM VAR. YUNNANENSE
Liu Runmin
Structure      13C NMR   碳谱模拟图
17 .     ent-8(14),15-sandaracopimaradiene-2α,18-diol
C20H32O2     相似度:65%
Phytochemistry          2001          56          203-210
Terpenoids from Guarea rhophalocarpa
Maria del Rayo Camacho, J.David Phillipson, Simon L Croft, Geoffrey C Kirby, David C Warhurst, Pablo N Solis
Structure      13C NMR   碳谱模拟图
18 .     das 16-acetylkirenol
C22H36O5     相似度:63.6%
Planta Medica          1991          57          396-396
Diterpene aus Siegesbeckia glabrescens Diterpenes from Siegesbeckia glabrescens
K Liu and E. Roder
Structure      13C NMR   碳谱模拟图
19 .     orientalin A
C22H36O5     相似度:63.6%
Natural Product Sciences          1997          3          14-18
The Constituents of Siegesbeckia orientalis
Xiong, Jiang; Ma, Yunbao; Xu, Yunlong
Structure      13C NMR   碳谱模拟图
20 .     10β-formamidokalihinol-A (s-trans)
C22H36ClNO3     相似度:63.6%
Tetrahedron          1996          52          2359-2368
Terpenoids with antifouling activity against barnacle larvae from the marine sponge Acanthella cavernosa
Hiroshi Hirota, Yasuhiko Tomono, Nobuhiro Fusetani
Structure      13C NMR   碳谱模拟图
21 .     16-acetylkirenol
C22H36O5     相似度:63.6%
Chinese Journal of Natural Medicines          2012          10          13-15
A new carbamate with cytotoxic activity from the aerial parts of Siegesbeckia pubecens
Jia LIU, Rong CHEN, Yu NIE, Lin FENG, Hai-Dao LI, Jing-Yu LIANG
Structure      13C NMR   碳谱模拟图
22 .     isopropylidenkirenol
C23H38O4     相似度:60.8%
Planta Medica          1991          57          396-396
Diterpene aus Siegesbeckia glabrescens Diterpenes from Siegesbeckia glabrescens
K Liu and E. Roder
Structure      13C NMR   碳谱模拟图
23 .     7α,13R,14R,15-tetrahydroxylabd-8(17)-ene
C20H35O4     相似度:60%
Phytochemistry          2006          67          1455-1459
Microbiological transformation of two labdane diterpenes, the main constituents of Madia species, by two fungi
Mamdouh S.A. Haridy, Ahmed A. Ahmed, Matsumi Doe
Structure      13C NMR   碳谱模拟图
24 .     2S-hydroperoxy-12R-hydroxyisobromosphaerol
C20H32Br2O4     相似度:60%
Journal of Natural Products          2008          71(8)          1386-1392
Brominated Diterpenes with Antibacterial Activity from the Red Alga Sphaerococcus coronopifolius
Vangelis Smyrniotopoulos, Constantinos Vagias, M.Mukhlesur Rahman, Simon Gibbons, and Vassilios Roussis
Structure      13C NMR   碳谱模拟图
25 .     19-hydroxypodocarp-8(14)-en-13-one
C17H26O2     相似度:60%
Journal of Natural Products          2006          69(4)          563-566
A New Route toward 7-Oxo-13-hydroxy-8,11,13-podocarpatrienes from Labdane Diterpenes
Enrique Alvarez-Manzaneda Roldn, Juan Luis Romera Santiago, and Rachid Chahboun
Structure      13C NMR   碳谱模拟图
26 .     ent-9α,17-dihydroxy-16-ketobeyeran-19-oic acid
C20H30O5     相似度:60%
Journal of Natural Products          2006          69          1450-1455
Transformation of Steviol-16α,17-epoxide by Streptomyces griseus and Cunninghamella bainieri
Shwu-Fen Chang, Li-Ming Yang, Feng-Lin Hsu, Ju-Yin Hsu, Jia-Horng Liaw, and Shwu-Jiuan Lin
Structure      13C NMR   碳谱模拟图
27 .     18-hydroxycassan-13,15-diene
C20H32O     相似度:60%
Journal of Natural Products          2003          66          928-932
Five New Cassane Diterpenes from Myrospermum frutescens with Activity against Trypanosoma cruzi
Daniel Torres Mendoza,Luis D. Urena Gonzalez,Eduardo Ortega-Barria,Todd L. Capson,and Luis Cubilla Rios
Structure      13C NMR   碳谱模拟图
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