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M201175065

金虫 (正式写手)

[求助] 维普求助,多谢 已有1人参与

13C NMR (101 MHz, Pyr) δ 13.05. 14.06, 21.21, 27.41, 29.94, 35, 31. 39. 76, 39.79, 40.05, 41.10, 44.92, 52.78, 56.87, 59.29, 74.98, 107.26, 125.61, 142.20, 150.26, 180.40,
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M201175065: 金币+10, ★★★★★最佳答案, 很好 2014-12-24 13:41:36
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
13.05,14.06,21.21,27.41,29.94,35.31,39.76,39.79, 40.05,41.10,44.92,52.78,56.87,59.29,74.98,107.26, 125.61,142.20,150.26,180.40  
溶剂选项: 全部 CDCl3 CD3CD2OD CD2Cl2 C5D5N C3D7NO CD3SOCD3 C4D8O CD3COOD C4D8O2 D2O CF3COOD CD3OD 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219个化合物(查询结果仅供参考)  
--------------------------------------------------------------------------------

1 .     henrilabdane A
C20H32O4     相似度:90%
Phytochemistry          2008          69          2867-2874
Bis-sesquiterpenes and diterpenes from Chloranthus henryi
Chuang-Jun Li, Dong-Ming Zhang, Yong-Ming Luo, Shi-Shan Yu, Yan Li, Yang Lu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     16-Methyl-12,15-epoxy-8(17),13-labdadien-19-oic acid
C20H30O3     相似度:85%
Journal of Asian Natural Products Research          2006          8          677-682
Labdane diterpenes from the seeds of Platycladus orientalis
X.-Y. REN and Y. YE
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     12R,15-dihydroxylabda-8(17),13E-dien-19-oic acid
C20H32O4     相似度:75%
Phytochemistry          2008          69          518-526
Diterpenoids from the pericarp of Platycladus orientalis
Ya-Zhou Wang, Chun-Ping Tang, Chang-Qiang Ke, Hans-Christoph Weiss,Ernst-Rudolf Gesing, Yang Ye
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     12R,15-dihydroxylabda-8(17),13Z-dien-19-oic acid
C20H32O4     相似度:75%
Phytochemistry          2008          69          518-526
Diterpenoids from the pericarp of Platycladus orientalis
Ya-Zhou Wang, Chun-Ping Tang, Chang-Qiang Ke, Hans-Christoph Weiss,Ernst-Rudolf Gesing, Yang Ye
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     15-hydroxy-12-oxolabda-8(17),13E-dien-19-oic acid
C20H30O4     相似度:75%
Phytochemistry          2008          69          518-526
Diterpenoids from the pericarp of Platycladus orientalis
Ya-Zhou Wang, Chun-Ping Tang, Chang-Qiang Ke, Hans-Christoph Weiss,Ernst-Rudolf Gesing, Yang Ye
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     12R,15-dihydroxy-8(17),13E-labdadien-19-oic acid
    相似度:75%
Tetrahedron Letters          2009          50          4185-4187
A novel sulfur-containing diterpenoid from Fritillaria anhuiensis
Qing-Yao Shou, Qing Tan, Zheng-Wu Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     henrilabdane B
C20H32O4     相似度:70%
Phytochemistry          2008          69          2867-2874
Bis-sesquiterpenes and diterpenes from Chloranthus henryi
Chuang-Jun Li, Dong-Ming Zhang, Yong-Ming Luo, Shi-Shan Yu, Yan Li, Yang Lu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     henrilabdane C
C20H30O4     相似度:70%
Phytochemistry          2008          69          2867-2874
Bis-sesquiterpenes and diterpenes from Chloranthus henryi
Chuang-Jun Li, Dong-Ming Zhang, Yong-Ming Luo, Shi-Shan Yu, Yan Li, Yang Lu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     acrostalic acid
    相似度:70%
Helvetica Chimica Acta          2009          92          1118-1125
Labdane and Tetranorlabdane Diterpenoids from Botryosphaeria sp. MHF, an Endophytic fungus of Maytenus hookeri
Lin Yuan, Pei-Ji Zhao, Juan Ma, Chun-Hua Lu, Yue-Mao Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     12,15-dihydroxylabda-8(17),13Z-dien-19-oic acid
C20H30O3     相似度:70%
Phytochemistry          1993          34          1581-1584
Diterpenes from the bark of Juniperus chinensis
Fang Jim-Min, Sou Yi-Chien, Chiu Yu-Hung, Cheng Yu-Shia
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     15,16-Epoxy-12-hydroxy-8(17),13(16),14-labdatrien-19-oic acid
C20H28O4     相似度:70%
Phytochemical Analysis          2006          17          32-35
Labdane Diterpenes from Juniperus communis L. Berries
Anne Marie Martin, Emerson Ferreira Queiroz, Andrew Marston and Kurt Hostettmann
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     13ξ,14β-dihydroxy-8(17)-labdaen-(15→16)-lactone-19-oicacid
C20H30O6     相似度:70%
Journal of Asian Natural Products Research          2014          16          555-564
Five new terpenoids from the rhizomes of Isodon adenantha
Xing-Li Zhou, Chao-Jiang Xiao, La-Bin Wu, Bo Huang, Xiang Dong & Bei Jiang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     16-hydroxy-8(17),13-ent-labdadien-15,16-olid-19-oic acid
C20H28O5     相似度:65%
Phytochemistry          2003                   1309-1317
ent-Labdane diterpenes from the aquatic plant Potamogeton pectinatus
Patrice Waridel, Jean-Luc Wolfender, Jean-Bernard Lachavanne, Kurt Hostettmann
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     labda-8(17),13(Z)-diene-15,19-dioic acid
C20H30O4     相似度:65%
Journal of Natural Products          1998          61          51-56
In Vitro Biotransformations of Isocupressic Acid by Cow Rumen Preparations:Formation of Agathic and Dihydroagathic Acids
Shwu-Jiuan Lin, Robert E. Short, Stephen P. Ford, Elaine E. Grings, and John P. N. Rosazza
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     (12R)-labda-8(17),13E-diene-12,15,19-triol
C20H34O3     相似度:65%
Planta Medica          2009          75          1344-1348
Terpenoids from Roots of Chloranthus henryi
Xianwen Gan, LeiMa, Qigang Chen, Qiuqun Chen, Qiang Yu, Lihong Hu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     Botryosphaerin E
C20H32O5     相似度:65%
Helvetica Chimica Acta          2009          92          1118-1125
Labdane and Tetranorlabdane Diterpenoids from Botryosphaeria sp. MHF, an Endophytic fungus of Maytenus hookeri
Lin Yuan, Pei-Ji Zhao, Juan Ma, Chun-Hua Lu, Yue-Mao Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

17 .     ((E)-Labda-8(17),12,14-trien-19-oic acid
C20H30O2     相似度:65%
Monatshefte für Chemie          2000          131          401-408
A Diterpene, a Flavonol Glycoside, and a Phytosterol Glycoside from Securidaca longipedunculata and Entada abyssinica
Asfaw Debella, Olaf Kunert, Martin G. Schmid, GuÈnter Michl, Franz Bucar, Dawit Abebe, and Ernst Haslinger
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

18 .     7β-hydroxyisocupressic acid
C21H34O4     相似度:60%
Journal of Natural Products          1998          61          922-926
Microbial Transformations of Isocupressic Acid
Shwu-Jiuan Lin and John P. N. Rosazza
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     12,15-epoxy-5αH,9βH-labda-8(17),13-dien-19-oic acid
C20H30O3     相似度:60%
Planta Medica          2006          72          1334-1338
Bioactive Terpenes from the Roots of Chloranthus henryi
Bin Wu , Shan He , Xiao-dan Wu , Yuan-jiang Pan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     12(R)-12,15-dihydroxylabda-8(17),13E-dien-19-oic acid
    相似度:60%
Planta Medica          2009          75          1344-1348
Terpenoids from Roots of Chloranthus henryi
Xianwen Gan, LeiMa, Qigang Chen, Qiuqun Chen, Qiang Yu, Lihong Hu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

21 .     11-hydroxyldrim-8,12-en-14-oic acid
C15H24O3     相似度:60%
Planta Medica          2009          75          1344-1348
Terpenoids from Roots of Chloranthus henryi
Xianwen Gan, LeiMa, Qigang Chen, Qiuqun Chen, Qiang Yu, Lihong Hu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

22 .     ent-13,17-dihydroxy-kaur-15-en-19-oic acid
    相似度:60%
Phytochemistry          1992          31          1553-1559
Minor diterpene glycosides from sweet leaves of Rubus suavissimus
Kazuhiro Ohtani, Yoko Aikawa, Ryoji Kasai, Wen-Hua Chou, Kazuo Yamasaki, Osamu Tanaka
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

23 .     7 α-Hydroxy-(-)-pimara-8(14),15-dien-19-oic acid
    相似度:60%
Archives of Pharmacal Research          2005          28          28-33
Inhibitory Constituents against Cyclooxygenases fromAralia cordata Thunb
Nguyen Hai Dang, XinFeng Zhang, MingShan Zheng, Kun Ho Son and Hyeun Wook Chang, et al.
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

24 .     (8R)-15,16-epoxy-8,17-dihydroxy-13(16),14-labdadien-18-oic acid
C20H30O5     相似度:60%
Russian Journal of Organic Chemistry          2006          42          36-41
Synthetic transformations of higher terpenoids: XII. Transformation of lambertianic acid into 14,16-epoxyabietane diterpenoids
S. V. Chernov, E. E. Shul’ts, M. M. Shakirov and G. A. Tolstikov
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

25 .     compound 25
    相似度:60%
Canadian Journal of Chemistry          1979          57          1550-1556
13C nuclear magnetic resonance studies. 85. 13C spectra of several ring-contracted and -expanded steroids
Vinod Dave, J. B. Stothers
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

26 .     Isostevic acid
    相似度:60%
Phytochemistry          2012          75          90-98
Oxygenated compounds from the bioconversion of isostevic acid and their inhibition of TNF-α and COX-2 expressions in LPS-stimulated RAW 264.7 cells
Li-Ming Yang, Shwu-Fen Chang, Wen-Kuang Lin, Bo-Hon Chou, Li-Hsuan Wang, Pan-Chun Liu, Shwu-Jiuan Lin
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

27 .     compound 3
C20H30O4     相似度:60%
Phytochemistry          2012          75          90-98
Oxygenated compounds from the bioconversion of isostevic acid and their inhibition of TNF-α and COX-2 expressions in LPS-stimulated RAW 264.7 cells
Li-Ming Yang, Shwu-Fen Chang, Wen-Kuang Lin, Bo-Hon Chou, Li-Hsuan Wang, Pan-Chun Liu, Shwu-Jiuan Lin
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

28 .     Platencin SL1
C20H30O4     相似度:60%
Journal of Natural Products          2012          75          2158-2167
Expression of the Platencin Biosynthetic Gene Cluster in Heterologous Hosts Yielding New Platencin Congeners
Michael J. Smanski, Jeffrey Casper, Ryan M. Peterson, Zhiguo Yu, Scott R. Rajski, and Ben Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

29 .     Platencin SL2
C18H28O3     相似度:60%
Journal of Natural Products          2012          75          2158-2167
Expression of the Platencin Biosynthetic Gene Cluster in Heterologous Hosts Yielding New Platencin Congeners
Michael J. Smanski, Jeffrey Casper, Ryan M. Peterson, Zhiguo Yu, Scott R. Rajski, and Ben Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

30 .     20-hydroxy-pregna-1-en-3-one
    相似度:57.1%
Drugs & Clinic          2014          29          11-15
Chemical constituents in ethyl acetate fraction from Scleronephthya sp.
YU Yang, LIU Zhen, LIN Wen-han, JI Yu-bin
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

31 .     14(RS),15-dihydroxy-8(17),12(E)-labdadien-19-oic-acid
C20H32O4     相似度:56.5%
Biochemical Systematics and Ecology          2012          45          16-19
Chemical constituents from Fritillaria anhuiensis
Qingyao Shou, Hans Wohlmuth, Xiaoxiang He, Lei Liu, Zhengwu Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

32 .     14-methoxy-15,16-dinor-5αH,9αH-labda-13(E),8(17)-dien-12 -one
C19H30O2     相似度:55%
Planta Medica          2006          72          1334-1338
Bioactive Terpenes from the Roots of Chloranthus henryi
Bin Wu , Shan He , Xiao-dan Wu , Yuan-jiang Pan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

33 .     12β,16α,17,19-tetrahydroxy-ent-kaurane
C20H34O4     相似度:55%
Chemical & Pharmaceutical Bulletin          1983          31          3865-3871
Chemical and Chemotaxonomical Studies on Filices. XLIII. Chemical Studies on the Constituents of Lindsaea javanensis BL., L. japonica (BAK.) DIELS and Tapeinidium pinnatum (CAV.) C. CHR.
TOSHIKO SATAKE,TAKAO MURAKAMI,YASUHISA SAIKI and CHIUMING CHEN
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

34 .     14(R),15-Dihydroxy-8(17),12(E)–labdadien-19-oic acid
C20H32O4     相似度:55%
Journal of Asian Natural Products Research          2006          8          677-682
Labdane diterpenes from the seeds of Platycladus orientalis
X.-Y. REN and Y. YE
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

35 .     15,16-Dihydroxy-8(17),13(E)–labdadien-19-oic acid
C20H32O4     相似度:55%
Journal of Asian Natural Products Research          2006          8          677-682
Labdane diterpenes from the seeds of Platycladus orientalis
X.-Y. REN and Y. YE
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

36 .     incarvine D
    相似度:55%
China Journal of Chinese Materia Medica          2009          34          1672-1675
Chemical constituents from roots of Incarvillea mairei
HUANG Zhengsheng, ZHANG Weidong, LIN Sheng, LIU Chunmei, HUANG Dasen, SONG Taifa, LU Longhai, PEI Yuehu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

37 .     6β,11α,17β,-Trihydroxy-17α-methylandrost-4-en-3-one
C20H30O4     相似度:55%
Phytochemistry          1996          42          411-415
The hydroxylation of testosterone and some relatives by Cephalosporium aphidicola
James R. Hanson, Habib Nasir, Aslam Parvez
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

38 .     compound 6m
    相似度:55%
Journal of Natural Products          1984          Vol 47          592-599
Cmr Spectroscopy of Labdanic Diterpenes and Related Substances
Josette Bastard, Do Khac Duc, Marcel Fetizon, Malcolm J. Francis, Peter K. Grant, Rex T. Weavers, Chikara Kaneko, G. Vernon Baddeley, Jean-Marie Bernassau, Ivor R. Burfitt, Peter M. Wovkulich, Ernest Wenkert
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

39 .     12,15-epoxy-8(17),13-labdadien-19-ol
C20H32O2     相似度:55%
Acta Pharmaceutica Sinica          2007          Vol 42          58-60
A new diterpenoid from Fritillaria anhuiensis
KANG Lu; ZHOU Jian-xia; SHEN Zheng-wu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

40 .     7β,15-dihydroxy-labd-8(17)-en
C20H36O2     相似度:55%
Phytochemistry          1991          30          2785-2787
Acetylenes and labdanes from Baccharis pedunculata
J. Jakupovic, A. Schuster, D.C. Wasshausen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

41 .     Pterisolic Acid B
C20H26O4     相似度:55%
Chemical & Pharmaceutical Bulletin          2011          59(4)          484-487
Pterisolic Acids A—F, New ent-Kaurane Diterpenoids from the Fern Pteris semipinnata
Fei WANG, Ya-Ju LI, Fu-Cai REN, Guo-Zhu WEI, and Ji-Kai LIU
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

42 .     ent-19-nor-atidan-4(18)-en-16α-ol
    相似度:55%
Phytochemistry          1988          27          3205-3208
Diterpenes from the fruits of Xylopia aromatica
Miguel P. L. Moraes,Nidia F. Roque
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

43 .     16-hydroxy-labda-8(17),13-diene-15,19-dioic acid butenolide
    相似度:55%
Phytochemistry          1989          28          1173-1175
Terpenoids from leaves of Calocedrus formosana
Jim-min Fang,Kuo-chio Hsu,Yu-shia Cheng
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

44 .     6β-hydroxy-7-oxo-ent-atis-16-en-19-oic acid
C20H28O4     相似度:55%
Phytochemistry          2010          71          1313-1321
Biotransformation of 7α-hydroxy- and 7-oxo-ent-atis-16-ene derivatives by the fungus Gibberella fujikuroi
Braulio M. Fraga, Pedro Gonzalez, Victoria Gonzalez-Vallejo, Ricardo Guillermo, Luz N. Diaz
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

45 .     Ent-12α,16β,17-trihydroxy-kauran-19-oic acid
C20H32O5     相似度:55%
Natural Product Research          2010          24          905-914
Biotransformation of ent-kaur-16-en-19-oic acid by Psilocybe cubensis
Jaraslak Pechwang; Prakitsin Sihanonth; Surachai Pornpakakul; Nongnuj Muangsin; Jittra Piapukiew; Alisa Vangnai; Narongsak Chaichit; Siriporn Chuchawankul; Amorn Petsom
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

46 .     compound 2
    相似度:55%
Pharmazie          2000          55          704-706
Analgetic properties of glycosyl diclofenac derivatives
J. Borowiecka - W. Pakulska - E. Czarnecka
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

47 .     7α-Hydroxy-ent-pimara-8(14),15-diene-19-oic acid
    相似度:55%
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
--------------------------------------------------------------------------------

48 .     8(17),13(E)-labdadien-15,19-dioic acid
    相似度:55%
Natural Product Research and Development          2008          20          1000-1004
Chemical Constituents from Amoora ouangtliensis and A.stellato-squamosa
YANG Shu-min;LIU Xi-kui*; WU Da-gang; ZHU Da-yuan
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

49 .     compound 19a
C20H31NO3     相似度:55%
Bioorganic & Medicinal Chemistry          2009          17          1464-1473
Stereoselective synthesis of bioactive isosteviol derivatives as α-glucosidase inhibitors
Ya Wu, Jing-Hua Yang, Gui-Fu Dai, Cong-Jun Liu, Guo-Qiang Tian, Wen-Yan Ma, Jing-Chao Tao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

50 .     ent-8β-cyanom-ethyl-13-methyl-12-podocarpen-19-oic acid
C20H29NO2     相似度:55%
Bioorganic & Medicinal Chemistry          2009          17          6348-6353
Microbial transformation of isosteviol oxime and the inhibitory effects on NF-κB and AP-1 activation in LPS-stimulated macrophages
Shwu-Fen Chang, Bo-Hon Chou, Li-Ming Yang, Feng-Lin Hsu, Wen-Kuang Lin, Yi Ho, Shwu-Jiuan Lin
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

51 .     2α-hydroxy-3-isobutyl-1,2,3,4,6,7-hexahydro-11bH-benzo[a]quinolizine
    相似度:55%
Journal of Medicinal Chemistry          1996          39          191-196
In Vitro and in Vivo Studies of Benzisoquinoline Ligands for the Brain Synaptic Vesicle Monoamine Transporter
Lihsueh C. Lee, Thierry Vander Borght, Phillip S. Sherman, Kirk A. Frey, and Michael R. Kilbourn
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

52 .     ceriponol I
C16H26O5     相似度:55%
Phytochemistry          2013          95          360-367
Ceriponols A-K, tremulane sesquitepenes from Ceriporia lacerate HS-ZJUT-C13A, a fungal endophyte of Huperzia serrata
You-Min Ying, Wei-Guang Shan, Li-Wen Zhang, Zha-Jun Zhan
Structure      13C NMR   碳谱模拟图
天道酬勤
2楼2014-12-04 19:18:45
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