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xf890529

木虫 (小有名气)

[求助] 求助4个微谱数据,谢谢

求助4个微谱数据,谢谢
化合物1:
22.72,26.93,28.41,45.54,54.66,59.34,109.86,111.71,118.59,120.03,122.81,123.54,126.78,136.77,165.66,169.51
化合物2:
22.79,29.27,29.60,32.21,45.39,49.09,49.95,55.83,58.96,68.81,71.39,83.42,95.15,105.06,109.93,120.82,121.27,131.91,137.23,156.56,166.24,171.56
化合物3:
22.22,28.92,29.78,32.58,45.92,47.69,55.86,56.75,60.04,84.77,95.35,104.11,109.82,109.93,118.56,122.48,135.23,136.44,156.29,166.06,167.04
化合物4:
18.38,25.63,48.65,54.17,54.64,105.58,111.78,118.19,119.43,120.21,122.33,126.42,127.35,127.42,134.05,134.82,134.88,146.68,154.39,159.38,169.20
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感谢参与,应助指数 +1
化合物1
1 .     brevianamide F
C24H17N3O     相似度:100%
Chemical & Pharmaceutical Bulletin          1994          42          2449-2451
Marine Natural Products. XXXIV. Trisindoline, a New Antibiotic Indole Trimer, Produced by a Bacterium of Vibrio sp. Separated from the Marine Sponge Hyrtios altum
Motomasa KOBAYASHI,Shunji AOKI,Katsuhiko GATO,Katsuyoshi MATSUNAMI,Michio KUROSU and Isao KITAGAWA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     cyclo(Trp-Pro)
C16H17N3O2     相似度:81.2%
Chemistry of Natural Compounds          2009          45          290-292
DIKETOPIPERAZINE CONSTITUENTSOF MARINE Bacillus subtilis
Xiaoling Lu, Yunheng Shen, Yuping Zhu,Qiangzhi Xu, Xiaoyu Liu, Kunyi Ni, Xin Cao,Weidong Zhang, and Binghua Jiao1
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     cyclo-D-Proline-L-tryptophan
C16H18N3O2     相似度:81.2%
Bioorganic & Medicinal Chemistry          2000          8          2407-2415
Synthesis and evaluation of microtubule assembly inhibition and cytotoxicity of prenylated derivatives of cyclo-l-Trp-l-Pro
Juan F Sanz-Cervera, Emily M Stocking, Takeo Usui, Hiroyuki Osada, Robert M Williams
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     Brevianamide F
    相似度:75%
Natural Product Sciences          2007          13          251-254
12,13-Dihydroxyfumitremorgin C, Fumitremorgin C, and Brevianamide F, Antibacterial Diketopiperazine Alkaloids from the Marine-Derived Fungus Pseudallescheria sp.
Zhang, Dahai; Noviendri, Dedi; Nursid, Muhammad; Yang, Xiu-Dong; Son, Byeng-Wha
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     Indol-3-yl-N-butylglycine
    相似度:68.7%
Molecules          2009          14          1056-1061
Efficient One-Pot Synthesis of Indol-3-yl-Glycines via Uncatalyzed Friedel-Crafts Reaction in Water
Mehdi Ghandi and Abuzar Taheri
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     Me N-acetyltryptophanate
    相似度:68.7%
Phytochemistry          1979          18          1869-1892
Carbon-13 NMR analysis of cyclic peptide alkaloids
M. Païs, F.-X. Jarreau, M.González Sierra, O.A. Mascaretti, Edmundo A. Ruveda, Ching-Jer Chang, Edward W. Hagaman, Ernest Wenkert
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     sumatriptan
    相似度:68.7%
Archiv der Pharmazie          2008          341          344-350
Unanticipated Acyloxymethylation of Sumatriptan Indole Nitrogen Atom and its Implications in Prodrug Design
Tiago Rodrigues, Rui Moreira, Rita C. Guedes, Jim Iley and Francisca Lopes
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     N-t-butyloxycarbonyl-L-tryptophan
C16H20N2O4     相似度:68.7%
Tetrahedron          2001          57          10181-10189
Novel tryptophan-derived dipeptides and bioactive metabolites from the sea hare Aplysia dactylomela
David R Appleton, Russell C Babcock, Brent R Copp
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     N-Prenyl-cyclo-L-tryptophyl-L-proline
C21H25N3O2     相似度:66.6%
Bioorganic & Medicinal Chemistry          2000          8          2407-2415
Synthesis and evaluation of microtubule assembly inhibition and cytotoxicity of prenylated derivatives of cyclo-l-Trp-l-Pro
Juan F Sanz-Cervera, Emily M Stocking, Takeo Usui, Hiroyuki Osada, Robert M Williams
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     N,N-dimethyl-2-(1-octyl-1H-indol-3-yl)ethanamine(N1-octyl-N10,N10-dimethyltryptamine)
C22H34N2O4     相似度:63.1%
Bioorganic & Medicinal Chemistry          2012          20          3719-3727
Synthesis and evaluation of N1-alkylindole-3-ylalkylammonium compounds as nicotinic acetylcholine receptor ligands
Edwin G. Pérez, Bruce K. Cassels, Christoph Eibl, Daniela Gündisch
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     6-prenyltryptophol
C15H19ON     相似度:62.5%
Journal of Natural Products          2003          66          863-864
New Cytotoxic Indolic Metabolites from a Marine Streptomyces
José M. Sánchez López,Marta Martínez Insua, Julia Pérez Baz, José L. Fernández Puentes, andLibrada M. Cañ edo Hernández
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     L-Tryptophan
C11H12N2O2     相似度:62.5%
Journal of Chinese Pharmaceutical Sciences          2004          13          18
Chemical Constituents from Starfish Asterias rollestoni
LI Guoqiang, DENG Zhi-wei, LI Jun, FU Hon-zheng, and LIN wen-han
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     tryptophan
    相似度:62.5%
Natural Product Sciences          2001          7          107-109
Anti-diabetic Constituent from the Node of Lotus Rhizome (Nelumbo nucifera Gaertn)
Lee, Min-Won; Kim, Jun-Sik; Cho, Su-Min; Kim, Ji-Hun; Lee, Jae-Seung
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     N-Malonyl-L-tryptophan
    相似度:62.5%
Phytochemistry          1992          31          823-826
N-acylamino acids from Ephedra distachya cultures
Kyung-Sik Song, Yoshifumi Ishikawa, Shigeo Kobayashi, Ushio Sankawa, Yutaka Ebizuka
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     N-Acetyltryptophan
C13H14N2O3     相似度:62.5%
Chemistry of Natural Compounds          2011          Vol. 47, No. 2          257-260
CHEMICAL AND BIOLOGICALLY ACTIVE CONSTITUENTS OF Salsola collina
Yong-Sheng Jin,Jing-Ling Du,Yan Yang,Li Jin,Yan Song,Wei Zhang,and Hai-Sheng Chen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     N,N-Diisopentyltryptamine
C20H32N2     相似度:62.5%
Bioorganic & Medicinal Chemistry          2011          19          3120-3127
Tryptamine derivatives as novel non-nucleosidic inhibitors against hepatitis B virus
Shi-Jin Qu , Gui-Feng Wang ,Wen-Hu Duan,Shan-Yan Yao, Jian-Ping Zuo , Chang-Heng Tan ,Da-Yuan Zhu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

17 .     6,7,12,12b-tetrahydro-1H-indolo[2,3-a]quinolizin-4-one
    相似度:62.5%
Heterocycles          2004          63          655-661
Syntheses of 1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]quinolizine and Harmicine Using a Chiral 1-Allyl-1,2,3,4-tetrahydro-β-carboline as the Starting Material
Takashi Itoh, Michiko Miyazaki, Kazuhiro Nagata, Shigeru Nakamura, and Akio Ohsawa*
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

18 .     L-Trp-p-PA
C18H17N3O3     相似度:62.5%
Bioorganic & Medicinal Chemistry Letters          2007          17          1601-1607
Synthesis of pseudopeptides based l-tryptophan as a potential antimicrobial agent
Jian Lv, Liang Yin, Tingting Liu, Yongmei Wang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

19 .     Glioperazine C
C15H17N3O3     相似度:62.5%
Bioscience, Biotechnology, and Biochemistry          2007          71          1979-1983
Glioperazine B, as a New Antimicrobial Agent against Staphylococcus aureus, and Glioperazine C: Two New Dioxopiperazines from Bionectra byssicola
Chang-Ji ZHENG, Young-Ho KIM and Won-Gon KIM
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

20 .     demethoxy-fumitremorgin C
C21H23N3O2     相似度:61.9%
Chinese Pharmaceutical Journal          2011          46          569-575
Antitumor Metabolites from Fungus Aspergillus sydowi D2-6
REN Hong, CAO Xue-li, WANG Qiao-e, XV Chun-ming
Structure      13C NMR   碳谱模拟图
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2楼2013-05-10 17:33:57
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yaolan123

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【答案】应助回帖

化合物2
1 .     12,13-dihydroxyfumitremorgin C
C22H25N3O5     相似度:77.2%
Chemistry of Natural Compounds          2004          40          615-617
FUMITREMORGINS FROM THE MARINE ISOLATE OF THE FUNGUS Aspergillus fumigatus
Sh. Sh. Afiyatullov, A. I. Kalinovskii, M. V. Pivkin,P. S. Dmitrenok, and T. A. Kuznetsova
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     10,11-dihydroxy-fumitremorgin C
C23H21N5O4     相似度:77.2%
Phytochemistry          1990          29          1025-1026
12,13-Dihydroxy-fumitremorgin C from Aspergillus fumigatus
Wolf-Rainer Abraham,Hans-Adolf Arfmann
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     12β-Hydroxyverruculogen TR-2
C22H27N3O6     相似度:72.7%
Journal of Agricultural and Food Chemistry          2012          60          3424-3431
Metabolites from Aspergillus fumigatus, an Endophytic Fungus Associated with Melia azedarach, and Their Antifungal, Antifeedant, and Toxic Activities
Xiao-Jun Li, Qiang Zhang, An-Ling Zhang, and Jin-Ming Gao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     12R,13S-Dihydroxyfumitremorgin C
    相似度:68.1%
Natural Product Sciences          2007          13          251-254
12,13-Dihydroxyfumitremorgin C, Fumitremorgin C, and Brevianamide F, Antibacterial Diketopiperazine Alkaloids from the Marine-Derived Fungus Pseudallescheria sp.
Zhang, Dahai; Noviendri, Dedi; Nursid, Muhammad; Yang, Xiu-Dong; Son, Byeng-Wha
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     9-Hydroxyfumitremorgin C
C22H25N3O4     相似度:63.6%
Chemistry & Biodiversity          2012          9          385-393
2,5-Diketopiperazines from the Marine-Derived Fungus Aspergillus fumigatus YK-7
Yu Wang, Zhan-Lin Li, Jiao Bai, Li-Min Zhang, Xin Wu, Lin Zhang,Yue-Hu Pei, Yong-Kui Jing, and Hui-Ming Hua
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     fumitremorgin C
C22H25N3O3     相似度:63.6%
Chinese Pharmaceutical Journal          2011          46          569-575
Antitumor Metabolites from Fungus Aspergillus sydowi D2-6
REN Hong, CAO Xue-li, WANG Qiao-e, XV Chun-ming
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     cyclotryprostatin C
C21H23N3O4     相似度:63.6%
Tetrahedron          1997          53          59-72
Novel mammalian cell cycle inhibitors, cyclotroprostatins A-D, produced by Aspergillus fumigatus, which inhibit mammalian cell cycle at G2/M phase
Cheng-Bin Cui, Hideaki Kakeya, Hiroyuki Osada
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     fumitremorgin B
    相似度:62.9%
Chemical & Pharmaceutical Bulletin          1980          28          245-254
Chemistry of Tremorogenic Metabolites. I. Fumitremorgin A from Aspergillus fumigatus
MIKIO YAMAZAKI,HARUHIRO FUJIMOTO and TAKAO KAWASAKI
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     Verruculogen
C27H33N3O7     相似度:62.9%
Chemistry of Natural Compounds          2004          40          615-617
FUMITREMORGINS FROM THE MARINE ISOLATE OF THE FUNGUS Aspergillus fumigatus
Sh. Sh. Afiyatullov, A. I. Kalinovskii, M. V. Pivkin,P. S. Dmitrenok, and T. A. Kuznetsova
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     compound 6
C27H33N3O6     相似度:62.9%
Tetrahedron          2008          64          7986-7991
Seven new prenylated indole diketopiperazine alkaloids from holothurian-derived fungus Aspergillus fumigatus
Fazuo Wang, Yuchun Fang, Tianjiao Zhu, Min Zhang, Aiqun Lin, Qianqun Gu, Weiming Zhu
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     20-Hydroxycyclotryprostatin B
C23H29N3O6     相似度:60.8%
Chemistry & Biodiversity          2012          9          385-393
2,5-Diketopiperazines from the Marine-Derived Fungus Aspergillus fumigatus YK-7
Yu Wang, Zhan-Lin Li, Jiao Bai, Li-Min Zhang, Xin Wu, Lin Zhang,Yue-Hu Pei, Yong-Kui Jing, and Hui-Ming Hua
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     12β-Hydroxy-13α-methoxyverruculogen TR-2
C23H29N3O6     相似度:60.8%
Journal of Agricultural and Food Chemistry          2012          60          3424-3431
Metabolites from Aspergillus fumigatus, an Endophytic Fungus Associated with Melia azedarach, and Their Antifungal, Antifeedant, and Toxic Activities
Xiao-Jun Li, Qiang Zhang, An-Ling Zhang, and Jin-Ming Gao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     rel-(8S)-19,20-dihydro-9,20-dihydroxy-8-methoxy-9,18-di-epi-fumitremorgin C
C23H29N3O6     相似度:60.8%
Helvetica Chimica Acta          2012          95          1401-1408
Diketopiperazine Alkaloids Produced by the Endophytic Fungus Aspergillus fumigatus from the Stem of Erythrophloeum fordiiOliv.
Yu-Xi Liu, Shuang-Gang Ma, Xiao-Jing Wang, Nan Zhao, Jing Qu, Shi-Shan Yu, Jun-Gui Dai, Ying-Hong Wang and Yi-Kang Si
Structure      13C NMR   碳谱模拟图
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3楼2013-05-10 17:35:06
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yaolan123

禁虫 (职业作家)

【答案】应助回帖

化合物3
1 .     20-Hydroxycyclotryprostatin B
C23H29N3O6     相似度:86.9%
Chemistry & Biodiversity          2012          9          385-393
2,5-Diketopiperazines from the Marine-Derived Fungus Aspergillus fumigatus YK-7
Yu Wang, Zhan-Lin Li, Jiao Bai, Li-Min Zhang, Xin Wu, Lin Zhang,Yue-Hu Pei, Yong-Kui Jing, and Hui-Ming Hua
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     12β-Hydroxy-13α-methoxyverruculogen TR-2
C23H29N3O6     相似度:86.9%
Journal of Agricultural and Food Chemistry          2012          60          3424-3431
Metabolites from Aspergillus fumigatus, an Endophytic Fungus Associated with Melia azedarach, and Their Antifungal, Antifeedant, and Toxic Activities
Xiao-Jun Li, Qiang Zhang, An-Ling Zhang, and Jin-Ming Gao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     rel-(8S)-19,20-dihydro-9,20-dihydroxy-8-methoxy-9,18-di-epi-fumitremorgin C
C23H29N3O6     相似度:86.9%
Helvetica Chimica Acta          2012          95          1401-1408
Diketopiperazine Alkaloids Produced by the Endophytic Fungus Aspergillus fumigatus from the Stem of Erythrophloeum fordiiOliv.
Yu-Xi Liu, Shuang-Gang Ma, Xiao-Jing Wang, Nan Zhao, Jing Qu, Shi-Shan Yu, Jun-Gui Dai, Ying-Hong Wang and Yi-Kang Si
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     12β-Hydroxyverruculogen TR-2
C22H27N3O6     相似度:77.2%
Journal of Agricultural and Food Chemistry          2012          60          3424-3431
Metabolites from Aspergillus fumigatus, an Endophytic Fungus Associated with Melia azedarach, and Their Antifungal, Antifeedant, and Toxic Activities
Xiao-Jun Li, Qiang Zhang, An-Ling Zhang, and Jin-Ming Gao
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     compound 4
    相似度:66.6%
Chemical & Pharmaceutical Bulletin          1980          28          245-254
Chemistry of Tremorogenic Metabolites. I. Fumitremorgin A from Aspergillus fumigatus
MIKIO YAMAZAKI,HARUHIRO FUJIMOTO and TAKAO KAWASAKI
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     cyclotryprostatin B
C23H27N3O5     相似度:65.2%
Chemistry of Natural Compounds          2004          40          615-617
FUMITREMORGINS FROM THE MARINE ISOLATE OF THE FUNGUS Aspergillus fumigatus
Sh. Sh. Afiyatullov, A. I. Kalinovskii, M. V. Pivkin,P. S. Dmitrenok, and T. A. Kuznetsova
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     cyclotryprostatin B
C23H27N3O5     相似度:65.2%
Tetrahedron          1997          53          59-72
Novel mammalian cell cycle inhibitors, cyclotroprostatins A-D, produced by Aspergillus fumigatus, which inhibit mammalian cell cycle at G2/M phase
Cheng-Bin Cui, Hideaki Kakeya, Hiroyuki Osada
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     rel-(8R)-9-hydroxy-8-methoxy-18-epi-fumitremorgin C
C23H27N3O5     相似度:65.2%
Helvetica Chimica Acta          2012          95          1401-1408
Diketopiperazine Alkaloids Produced by the Endophytic Fungus Aspergillus fumigatus from the Stem of Erythrophloeum fordiiOliv.
Yu-Xi Liu, Shuang-Gang Ma, Xiao-Jing Wang, Nan Zhao, Jing Qu, Shi-Shan Yu, Jun-Gui Dai, Ying-Hong Wang and Yi-Kang Si
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     rel-(8S,19S)-19,20-dihydro-9,19S,20-trihydroxy-8-methoxy-9-epi-fumitremorgin C
C23H29N3O7     相似度:65.2%
Helvetica Chimica Acta          2012          95          1401-1408
Diketopiperazine Alkaloids Produced by the Endophytic Fungus Aspergillus fumigatus from the Stem of Erythrophloeum fordiiOliv.
Yu-Xi Liu, Shuang-Gang Ma, Xiao-Jing Wang, Nan Zhao, Jing Qu, Shi-Shan Yu, Jun-Gui Dai, Ying-Hong Wang and Yi-Kang Si
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     compound 2
C22H25N3O6     相似度:63.6%
Records of Natural Products          2012          6:1          28-34
Secondary Metabolites of Aspergillus sp. CM9a, an Endophytic Fungus of Cephalotaxus mannii
Heng Xue, Chunhua Lu, Lanying Liang and Yuemao Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

11 .     Compound 2
C22H25N3O6     相似度:63.6%
Records of Natural Products          2012          6          28-34
Secondary Metabolites of Aspergillus sp. CM9a,an Endophytic Fungus of Cephalotaxus mannii
Heng Xue,Chunhua Lu,Lanying Liang and Yuemao Shen
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

12 .     cyclotryprostatin A
C22H25N3O5     相似度:63.6%
Tetrahedron          1997          53          59-72
Novel mammalian cell cycle inhibitors, cyclotroprostatins A-D, produced by Aspergillus fumigatus, which inhibit mammalian cell cycle at G2/M phase
Cheng-Bin Cui, Hideaki Kakeya, Hiroyuki Osada
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

13 .     tryprostation A
C22H27N3O3     相似度:63.6%
Bioorganic & Medicinal Chemistry          2008          16          4626-4651
Synthesis and structure–activity relationship studies on tryprostatin A, an inhibitor of breast cancer resistance protein
Hiteshkumar D. Jain, Chunchun Zhang, Shuo Zhou, Hao Zhou, Jun Ma, Xiaoxiang Liu, Xuebin Liao, Amy M. Deveau, Christine M. Dieckhaus, Michael A. Johnson, Kirsten S. Smith, Timothy L. Macdonald, Hideaki Kakeya, Hiroyuki Osada, James M. Cook
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

14 .     compound 5
C22H27N3O3     相似度:63.6%
Bioorganic & Medicinal Chemistry          2008          16          4626-4651
Synthesis and structure–activity relationship studies on tryprostatin A, an inhibitor of breast cancer resistance protein
Hiteshkumar D. Jain, Chunchun Zhang, Shuo Zhou, Hao Zhou, Jun Ma, Xiaoxiang Liu, Xuebin Liao, Amy M. Deveau, Christine M. Dieckhaus, Michael A. Johnson, Kirsten S. Smith, Timothy L. Macdonald, Hideaki Kakeya, Hiroyuki Osada, James M. Cook
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

15 .     tryprostatin A
C22H27N3O3     相似度:63.6%
The Journal of Antibiotics          1996          49          534-540
Novel Mammalian Cell Cycle Inhibitors, Tryprostatins A, B and Other Diketopiperazines Produced by Aspergillus fumigatus II. Physico-chemical Properties and Structures
CHENG-BIN CUI, HIDEAKI KAKEYA, HIROYUKI OSADA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

16 .     3-(6-methoxy-1H-indol-3-ylmethyl)-hexahydro-pyrrolo[1,2-a]pyrazine-1,4-dione
C17H19N3O3     相似度:61.9%
Bioorganic & Medicinal Chemistry          2008          16          4626-4651
Synthesis and structure–activity relationship studies on tryprostatin A, an inhibitor of breast cancer resistance protein
Hiteshkumar D. Jain, Chunchun Zhang, Shuo Zhou, Hao Zhou, Jun Ma, Xiaoxiang Liu, Xuebin Liao, Amy M. Deveau, Christine M. Dieckhaus, Michael A. Johnson, Kirsten S. Smith, Timothy L. Macdonald, Hideaki Kakeya, Hiroyuki Osada, James M. Cook
Structure      13C NMR   碳谱模拟图
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4楼2013-05-10 17:36:49
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yaolan123

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【答案】应助回帖

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xf890529: 金币+40, ★★★★★最佳答案, 感谢! 2013-05-10 17:42:28
化合物4
1 .     (6S,14S)-14,15-dihydro-6-methyl-6,14-(iminomethano)-5H-indolo-[2',3':4,5]azepino[2,1-b]quinazoline-12,15(6H)-dione
C21H16N4O2     相似度:95.2%
Journal of the American Chemical Society          2001          123          5892-5899
Synthesis of ent-Alantrypinone
David J. Hart and Nabi A. Magomedov
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

2 .     fumiquinazolines J
C21H16N4O2     相似度:66.6%
China Journal of Chinese Materia Medica          2007          32          1848-1851
Study on Indole-Quinazolines Alkaloids from Marine-Derived Fungus Aspergillus sydowi PFW-13 and their Anti-Tumor Activities
ZHANG Min, FANG Yuchun, ZHU Tianjiao, ZHAO Wenying, GU Qianqun, HAN Xiaoxian, ZHU Weiming
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

3 .     sartorymensin
C23H20N4O2     相似度:65.2%
Tetrahedron          2012          68          3253-3262
Sartorymensin, a new indole alkaloid, and new analogues of tryptoquivaline and fiscalins produced by Neosartorya siamensis (KUFC 6349)
Suradet Buttacho
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

4 .     fumiquinazolines F
C21H18N4O2     相似度:61.9%
China Journal of Chinese Materia Medica          2007          32          1848-1851
Study on Indole-Quinazolines Alkaloids from Marine-Derived Fungus Aspergillus sydowi PFW-13 and their Anti-Tumor Activities
ZHANG Min, FANG Yuchun, ZHU Tianjiao, ZHAO Wenying, GU Qianqun, HAN Xiaoxian, ZHU Weiming
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

5 .     2-acetylamino-5-benzyl-5H-indolo[2,3-b]quinoxaline
C23H18N4O     相似度:61.9%
Heterocycles          2008          75          2745-2759
Regioselective Syntheses of 1-, 2-, 3- and 4-Aminoindolo[2, 3-b]quinoxalines
Aurélie Jaouen, Philippe Helissey, Stéphanie Desbène-Finck, and Sylviane Giorgi-Renault
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

6 .     Fumiquinazoline F
C21H18N4O2     相似度:61.9%
Journal of the Chemical Society, Perkin Transactions 1          1995                   2345-2353
Fumiquinazolines A–G, novel metabolites of a fungus separated from a Pseudolabrus marine fish
Chika Takahashi, Tomochika Matsushita, Mitsunobu Doi, Katsuhiko Minoura, Tetsuro Shingu, Yuko Kumeda and Atsushi Numata
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

7 .     (Z)-2,4-dichloro-N-(2-(diethylamino)ethyl)-5-((5-fluoro-2-oxoindolin-3-ylidene)methyl)-1H-pyrrole-3-carboxamide
C20H21Cl2FN4O2     相似度:61.9%
Molecules          2011          16          9368-9385
Synthesis and Biological Evaluation of 3-Substituted-indolin-2-one Derivatives Containing Chloropyrrole Moieties
Yun-Zhou Jin, Da-Xu Fu, Nan Ma, Zhan-Cheng Li, Quan-Hai Liu, Lin Xiao and Rong-Hua Zhang
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

8 .     7-(6-methoxynapthalyl)triazolylheptahydroxamic acid
C20H24N4O3     相似度:61.9%
Bioorganic & Medicinal Chemistry          2008          16          4839-4853
Synthesis and structure–activity relationship of histone deacetylase (HDAC) inhibitors with triazole-linked cap group
Po C. Chen, Vishal Patil, William Guerrant, Patience Green, Adegboyega K. Oyelere
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

9 .     tryprostatin B
C21H25N3O2     相似度:61.9%
The Journal of Antibiotics          1996          49          534-540
Novel Mammalian Cell Cycle Inhibitors, Tryprostatins A, B and Other Diketopiperazines Produced by Aspergillus fumigatus II. Physico-chemical Properties and Structures
CHENG-BIN CUI, HIDEAKI KAKEYA, HIROYUKI OSADA
Structure      13C NMR   碳谱模拟图
--------------------------------------------------------------------------------

10 .     Compound 9
C25H30N2O2     相似度:60%
Magnetic Resonance in Chemistry          2005          43          869-872
Complete assignments of 1H and 13C NMR data for ten phenylpiperazine derivatives
Zhihui Xiao, Mu Yuan, Si Zhang, Jun Wu, Shuhua Qi and Qingxin Li
Structure      13C NMR   碳谱模拟图
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5楼2013-05-10 17:37:59
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