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常雨

木虫 (小有名气)

[求助] 微谱数据求助,化合物解析

碳谱数据如下
化合物1:
16.4,17.1,17.2,17.3,18.7,21.4,22.2,22.7,24.3,26.9,29.1,31.1,33.4,33.7,34.7,35.2,
39.4,41.5,42.2,42.2,44.4,50.0,50.1,50.6,51.4,51.5,54.2,55.9,65.6,74.2
化合物2:
12.2,12.3,19.0,19.3,19.8,20.1,21.3,23.4,24.2,24.4,26.5,28.5,29.5,30.0,34.2,34.5,36.4,37.4,38.3,38.9,39.9,42.8,46.2,53.9,56.3,56.4,73.6,126.6,168.7,200.6
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Keydream

木虫 (正式写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
常雨: 金币+15, ★★★★★最佳答案 2012-06-26 21:17:21
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
16.4,17.1,17.2,17.3,18.7,21.4,22.2,22.7,24.3,26.9,29.1,31.1,33.4,33.7,34.7,35.2,39.4,41.5,42.2,42.2,44.4,50.0,50.1,50.6,51.4,51.5,54.2,55.9,65.6,74.2  
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9419个化合物(查询结果仅供参考)  
--------------------------------------------------------------------------------

1 .     2-hydroxydiplopterol
    相似度:100%
Archives of Pharmacal Research          2009          32          1211-1214
2-Hydroxydiplopterol, a new cytotoxic pentacyclic triterpenoid from the halotolerant fungus Aspergillus variecolor B-17
Wen-Liang Wang, Pei-Pei Liu, Ya-Peng Zhang, Jing Li and Hong-Wen Tao, et al.
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

2 .     22-hydroxyhopane
    相似度:86.6%
Chemical & Pharmaceutical Bulletin          1993          41          1939-1943
NMR Spectra of Triterpenoids. I. Conformation of the Side Chain of Hopane and Isohopane, and Their Derivatives
Hiroyuki AGETA,Kenji SHIOJIMA,Hideki SUZUKI and Sachiko NAKAMURA
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

3 .     zeorinone
    相似度:86.6%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

4 .     compound 10
    相似度:86.6%
Phytochemistry          1993          32          1235-1237
Sesqui- and triterpenoids of the liverwort Conocephalum japonicum
Masao Toyota, Yoshinori Asakawa
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

5 .     hydroxyhopanone
C30H50O2     相似度:86.6%
Phytochemistry          1992          31          3535-3539
Saturated hopane and gammacerane triterpene-diols from the stem bark of Abies veitchii
Reiko Tanaka, Shunyo Matsunaga
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

6 .     22-hydroxyhopane
    相似度:86.6%
Chinese Pharmaceutical Journal          2008          43          18-20
Studies on Chemical Constituents of Marchantia polymorpha L.
FANG Lei, NIU Chong, LOU Hong-xiang
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

7 .     hydroxyhopane
    相似度:86.6%
Chinese Journal of Medicinal Chemistry          2008          18          291-293
Chemical constituents from the root of Lygodium japonicum(Thunb.) Sw.
ZHU Lin-xia, ZHANG Guo-gang, WANG Sheng-chao, ZUO Tian-tian
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

8 .     hydroxyhopanone
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1996          44          1033-1038
Chemical Evaluation of Betula Species in Japan. II. Constituents of Betula platyphylla var. japonica
Hiroyuki FUCHINO,Soh KONISHI,Tetsuya SATOH,Akiko YAGI,Kohei SAITSU,Tatsuya TATSUMI and Nobutoshi TANAKA
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

9 .     diploterol
    相似度:83.3%
Acta Bot. Boreal. -Occident. Sin.          2008          28          1246-1249
Chemical Constituents in the Leaves of Alsophila spinulosa
CHEN Feng-zheng, XIANG Qing-xiang, LI Shu-hua
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

10 .     hydroxyhopane
    相似度:83.3%
Journal of Natural Products          1990          Vol 53          325
Chemotaxonomy of Ferns, 3. Triterpenoids from Polypodium polypodioides
Hiroyuki Ageta, Yoko Arai
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

11 .     diplopterol
    相似度:83.3%
Phytochemistry          1994          35          1293-1296
Triterpenes from Fossombronia liverworts
Carola Grammes, Gunther Burkhardt, Hans Becker
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

12 .     diploterol
    相似度:83.3%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

13 .     compound 338
    相似度:83.3%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

14 .     methyl aipolate
    相似度:83.3%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

15 .     compound 4
    相似度:83.3%
Chemical & Pharmaceutical Bulletin          1987          35          4016-4021
Chemical and Chemotaxonomical Studies of Filices. LXXI. Chemical Studies on the Constituents of Cheiropleuria bicuspis (BL.) PR.
NOBUTOSHI TANAKA,HIROSHI WADA,MASAAKI KOJIMA,TAKAO MURAKAMI,YASUHISA SAIKI,CHIU-MING CHEN and YOICHI IITAKA
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

16 .     22-hydroxyhopan-3-one
    相似度:83.3%
Chinese Journal of Medicinal Chemistry          2009          19          195-199
Triterpenoidal constituents of Pericampylus glaucus and their antitumor activity in vitro
ZHAO We i-quan, CUI Cheng-bin
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

17 .     Hopan-22-01
C31H54O     相似度:83.3%
Chemical Communications          1984                   1657-1658
Occurrence of Triterpenoids in Methanol-oxidizing Bacteria. 2-Methyl-22- hydroxyhopane from Corynebacterium
André Babadjamian, Robert Faure, Michèle Laget, Gerard Dumenil and Prudent Padieu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

18 .     hydroxyhopane
    相似度:80%
Chemical & Pharmaceutical Bulletin          1990          38          2130-2132
Fern Constituents : Triterpenoids Isolated from the Leaves of Cheiropleuria bicuspis
Rumiko KAMAYA,Yoshiko TANAKA,Rie HIYAMA and Hiroyuki AGETA
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

19 .     zeorin
    相似度:80%
China Journal of Chinese Materia Medica          2009          34          708-711
Studies on chemical constituents from herbs of Usnea longissima
FENG Jie, YANG Xiuwei, SU Siduo, HE Chuan
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

20 .     hopane 6α,22-diol
    相似度:80%
Natural Product Sciences          2000          6          102-105
Triterpenoids of Gordonia dassanayakei
Herath, H.M.T.B.; Athukoralage, P.S.
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

21 .     zeorin
    相似度:80%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

22 .     6α-acetoxyhopan-22-ol
    相似度:80%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

23 .     compound 352
    相似度:80%
Phytochemistry          1994          37          1517-1575
13C NMR Spectra of pentacyclic triterpenoids—a compilation and some salient features
Shashi B. Mahato, Asish P. Kundu
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

24 .     compound 7
C30H52O2     相似度:80%
Phytochemistry          1992          31          3535-3539
Saturated hopane and gammacerane triterpene-diols from the stem bark of Abies veitchii
Reiko Tanaka, Shunyo Matsunaga
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

25 .     3-oxo-22-hydroxyhopane
C30H50O2     相似度:80%
Chinese Traditional and Herbal Drugs          2000          31          89-90
Triterpenoid from Chinese Eaglewood (Aquilaria sinensis)
South China Institute of Botany; Chinese Academy of Sciences (Guangzhou )Lin Lidong and Qi Shuyuan
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

26 .     6α,22-dihydroxyhopane
    相似度:80%
Chinese Pharmaceutical Journal          2008          43          18-20
Studies on Chemical Constituents of Marchantia polymorpha L.
FANG Lei, NIU Chong, LOU Hong-xiang
Structure      13C NMR   碳谱模拟图
2楼2012-06-26 20:01:02
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Keydream

木虫 (正式写手)

【答案】应助回帖

★ ★ ★ ★ ★
常雨: 金币+5 2012-06-26 21:17:35
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
12.2,12.3,19.0,19.3,19.8,20.1,21.3,23.4,24.2,24.4,26.5,28.5,29.5,30.0,34.2,34.5,36.4,37.4,38.3,38.9,39.9,42.8,46.2,53.9,56.3,56.4,73.6,126.6,168.7,200.6

  
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9844个化合物(查询结果仅供参考)  
--------------------------------------------------------------------------------

1 .     6-hydroxystigmast-4-en-3-one
C29H48O2     相似度:96.6%
Steroids          2006          71          647-652
Ketosteroids and hydroxyketosteroids, minor metabolites of sugarcane wax
Patricia Georges, Muriel Sylvestre, Heinz Ruegger, Paul Bourgeois
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

2 .     stigmast-4-en-6β-ol-3-one
C29H48O2     相似度:96.6%
Journal of Asian Natural Products Research          2001          3          299-311
CONSTITUENTS FROM LIMONIA CRENULATA
XUE-ME1 NIU, SHENG-HONG LI, LI-YAN PENG,and HAN-DONG SUN,ZHONG-WEN LIN, GAO-XIONG RAO
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

3 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
China Journal of Chinese Materia Medica          2008          33          1566-1568
Studies on chemical constituents from stem bark of Trwia nudiflora
WU Shaohua, SHENG Yuemao, CHEN Youwei, YANG Liyuan, LI Shaolan, LI Zhiying
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

4 .     (24R)-6β-hydroxy-24-ethylcholest-4-en-3-one
C29H48O2     相似度:96.6%
Phytochemistry          1998          48          471-474
Chemical constituents of aquatic fern Azolla nilotica
Yôko Arai, Tomomi Nakagawa, Mari Hitosugi, Kenji Shiojima, Hiroyuki Ageta, Osama Basher, Abdel-Halim
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

5 .     stigmastan-4-en-6β-ol-3-one
C29H4802     相似度:96.6%
Journal of Natural Products          1990          Vol 53          1430
Stigmasterols from Typha latifolia
Marina Della Greca, Pietro Monaco, Lucio Previtera
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

6 .     6β-Hydroxy-4-stigmasten-3-one
    相似度:96.6%
Natural Product Sciences          2007          13          332-336
Norsesquiterpene and Steroid Constituents of Humulus japonicus
Yu, Byung-Chul; Yang, Min-Cheol; Lee, Kyu-Ha; Kim, Ki-Hyun; Lee, Kang-Ro
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

7 .     (24R)-6β-hydroxy-24-ethylcholest-4-en-3-one
    相似度:96.6%
Korean Journal of Pharmacognosy          2007          38(4)          376-381
Isolation of Melanin Biosynthesis Inhibitory Compounds from the Seeds of Plantago asiatica L.
Oh, Joon-Seok; Lee, Jong-Gu; Jung, Hee-Wook; Choi, Ji-Young; Choi, Eun-Hyang; Kim, Dong-Chun; Kim, Jeong-Ah; Son, Jong-Keun; Lee, Seung-Ho
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

8 .     6β-hydroxy-stigmasta-4-en-3-one
    相似度:96.6%
China Journal of Chinese Materia Medica          2011          Vol 36,Issue 7          891-895
Chemical constituents from petroleum ether portion of Abelmoschus esculentus
JIA Lu, GUO M ingm ing, LI Dong, JING Lin lin
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

9 .     Stigmast-4-en-6β-ol-3-one
C29H48O2     相似度:96.6%
Natural Product Research          2011          Vol. 25, No. 13          1243-1249
Chemical constituents from the roots of Xanthium sibiricum
Suqin Kan, Guangying Chen, Changri Han, Zhong Chen, Xinming Song, Ming Ren and Hong Jiang
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

10 .     6β-hydroxy-stigmast-4-en-3-one
    相似度:96.6%
Chinese Traditional and Herbal Drugs          2007          38          14-17
Chemical constituents of whole herb of Dicliptera chinensis
GAO Yu-tao; YANG Xiu-wei; AI Tie-min
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

11 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Chinese Traditional and Herbal Drugs          2007          38          348-350
瓶花木化学成分的研究
陶曙红;潘剑宇;漆淑华;李庆欣;张偲
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

12 .     stigmast-4-en-6β-ol-3-one
C29H48O2     相似度:96.6%
Chinese Traditional and Herbal Drugs          2005          36          510-511+545
牛耳朵化学成分的研究
蔡祥海,邓德山,马云保,罗晓东
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

13 .     stigmast-4-en-6β-ol-3-one
C29H48O2     相似度:96.6%
Chinese Traditional and Herbal Drugs          2001          32          778-780
Studies on chemical constituents of Cipadessa baccifera
LUO Xiao dong; WU Shao hua; MA Yun bao; WU Da gang
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

14 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Chinese Journal of Natural Medicines          2009          7          425-427
Chemical Constituents from Houttuynia cordata
QU Wei; LIANG Jing-Yu; LI Meng-Ran
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

15 .     Stignast-4-en-6β-3-one
    相似度:96.6%
Chinese Journal of Natural Medicines          2010          8          16-20
Chemical Constituents from Helwingia japonica
XIA Li-Zi; ZHOU Min; XIAO Yan-Hua; LI Guo-You; CHEN Xiao-Zhen; ZHANG Guo-Lin
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

16 .     6β-Hydroxyenone (Stigmast-4-en-6β-ol-3-one)
    相似度:96.6%
Pharmazie          2004          59          885-888
Terpenoids and steroids from Lappula anocarpa
Yuan-Peng Jin, and Yan-Ping Shi
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

17 .     (24R)-6β-hydroxy-24-ethyl-cholest-4-en-3-one
    相似度:96.6%
Chinese Pharmaceutical Journal          2005          40          255-258
Study on phenolic constituents of Pholidota yunnanensis
BI Zhi ming, WANG Zheng tao *, XU Luo shan, XU Guo jun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

18 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Chinese Pharmaceutical Journal          2010          45          1615-1617
Chemical Constituents of Tetrastigma planicaule(Hook.) Gagnep.
SHAO Jia-chun, HE Cui-hong, LEI Ting, HONGi-hua, CEN Ying-zhou
Structure      13C NMR   碳谱模拟图

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19 .     6β-hydroxystigmast-4-en-3-one
    相似度:96.6%
Modern Chinese Medicine          2010          12(1)          23-24
Study on the Chemical Constituents of from the Roots of Tripterygium wilfordii
Yan Zhen, Tian Yang, Ma Yueping, Fu Xiaochun, Zhang Zhenxue, Wang Jinhui
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

20 .     6β-hydroxystigmast-4-en-3-one
    相似度:96.6%
Chinese Journal of Medicinal Chemistry          2003          13          211-214
Studies on the chemical constituents of Fructus Ailanthi altissimae
ZHAO Chun-chao, WANG Jin-hui, LI Wen, SHA Yi, LI Xian
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

21 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Journal of Shenyang Pharmaceutical University          2009          26          874-877
Isolation and identification of steroids from the leaves of theMagnolia sieboldii K. Koch
WANG Ru-ping, WU Di, GAO Hui-yuan, SUN Bo-hang, HUANG Jian, WU Li-jun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

22 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Journal of Shenyang Pharmaceutical University          2009          26          23-26
Chemical constituents from the involucre of Castanea mollissima Blume
JIAO Qi-yang, WU Li-jun, HUANG Jian, SUN Bo-hang, GAO Hui-yuan
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

23 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Journal of Shenyang Pharmaceutical University          2009          26          357-360
Isolation and identification of chemical constituents from testa of Castanea mollissima Blume
LU Chuan, WU Zhao-hua, GAO Hui-yuan, SUN Bo-hang, HUANG Jian, WU Li-jun
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

24 .     (24R)-6β-羟基-24-乙基-胆甾-4-烯-3-酮
    相似度:96.6%
Journal of Shenyang Pharmaceutical University          2007          24          611-614
Chemical constituents of Duchesnea indica Focke
XU Wen-dong, LIN Hou-wen, QIU Feng, CHEN Wan-sheng
Structure      13C NMR   碳谱模拟图

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25 .     tigmast-4-en-6β-ol-3-one
    相似度:96.6%
Natural Product Research and Development          2010          22          995-997
Chemical Constituent of Active Fraction from Radix Aerio Fici microcarpae L.
YA Qi-kang; LU Wen-jie; CHEN Jia-yuan; TAN Xiao
Structure      13C NMR   碳谱模拟图

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26 .     stigmast-4-ene-6β-ol-3-one
    相似度:96.6%
Natural Product Research and Development          2009          21          960-962
Study on the Chemical constituents of Callipteris esculenta(Athyriaceae)
WANG Zi-juan;ZHAO Qin-shi; PENG Li-yan; CHENG Xiao
Structure      13C NMR   碳谱模拟图

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27 .     stigmast-4-en-6β-ol-3-one
    相似度:96.6%
Natural Product Research and Development          1999          11(1)          44-47
THE CONSTITUNETS OF PIPER BOEHMERIAEFOLIUM VAR. TONKINENSE
Zhang Ke; Ni Wei; Chen Changxiang
Structure      13C NMR   碳谱模拟图

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28 .     6-Hydroxystigmast-4-en-3-one
C29H48O2     相似度:93.3%
Chemistry of Natural Compounds          2007          43          563-566
CHEMICAL CONSTITUENTS FROM THE ROOTS OF Polygonum bistorta
Xiao-Bai Sun, Pei-Hua Zhao, Yang-Jun Xu,Li-Mei Sun, Mei-Ai Cao, and Cheng-Shan Yuan
Structure      13C NMR   碳谱模拟图

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29 .     6β-hydroxy stigmast-4-en-3-one
    相似度:93.3%
Phytochemistry          1999          50          1229-1236
Triterpenoids from Mangifera indica
V. Anjaneyulu , P. Satyanarayanα, K.N. Viswanadham, V.G. Jyothi, K. Nageswara Rao, P. Radhika
Structure      13C NMR   碳谱模拟图

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30 .     Procesterol
C29H48O     相似度:93.3%
Chemistry of Natural Compounds          2012          48          155-157
CHARACTERIZATION OF CHEMICAL CONSTITUENTS OF Calotropis procera
Arun Kakkar,D. R. Verma,Sanjay Suryavanshi,and Pradeep Dubey
Structure      13C NMR   碳谱模拟图

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31 .     procesterol
C29H48O2     相似度:93.3%
Phytochemistry          1989          28          2859-2861
A steroid from Calotropis procera
Abdul Qasim Khan,Abdul Malik
Structure      13C NMR   碳谱模拟图

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32 .     7-O-β-sitosterol
    相似度:93.3%
Chinese Traditional and Herbal Drugs          2008          39          497-499
Chemical constituents from roots of Euphorbia songarica
LIN Jia AN Ning LIU Chun-yu XU Li-zhen
Structure      13C NMR   碳谱模拟图

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33 .     stigmast-4-en-6β-ol-3-one
    相似度:93.3%
Pharmazie          2005          60          464-467
Steroids from Saussurea ussuriensis
Jia-Tao Feng and Yan-Ping Shi
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

34 .     (24R)-ethylcholest-5-en-3-ol-7-one
    相似度:93.3%
Bulletin of the Korean Chemical Society          2008          29          615-619
Human Acyl-CoA: Cholesterol Acyltransferase (hACAT) Inhibitory Activities of Triterpenoids from Roots of Glycine max (L.) Merr.
Jin Hwan Lee, Young Bae Ryu, Byong Won Lee, Jin Hyo Kim, Woo Song Lee, Yong-Dae Park, Tae-Sook Jeong, Ki Hun Park*
Structure      13C NMR   碳谱模拟图

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35 .     6β-hydroxystigmast-4-en-3-one
    相似度:93.3%
Natural Product Research and Development          2006          18          238-242
Chemical Study on Porandra scandens
HE Zhi-heng; LUO Ying-gang; LI Hong-juan(; ZHANG Guo-lin
Structure      13C NMR   碳谱模拟图

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36 .     6-hydroxystigmasta-4,22-dien-3-one
    相似度:86.6%
China Journal of Chinese Materia Medica          2009          34          712-714
Chemical constituents from Hedyotis diffusa
HUANGWeihua , LI Youbin , JIANG Jianqin
Structure      13C NMR   碳谱模拟图

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37 .     6β-hydroxy-24-ethylcholesta-4,24(28)-dien-3-one
C29H46O2     相似度:83.3%
Journal of Natural Products          1999          62          224-227
New Cytotoxic Oxygenated Fucosterols from the Brown Alga Turbinaria conoides
Jyh-Horng Sheu, Guey-Horng Wang, Ping-Jyun Sung, and Chang-Yih Duh
Structure      13C NMR   碳谱模拟图

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38 .     6β-Hydroxycampest-4-en-3-one
C28H47O2     相似度:83.3%
Steroids          2000          65          443-449
Synthesis of 6-oxy functionalized campest-4-en-3-ones: efficient hydroperoxidation at C-6 of campest-5-en-3-one with molecular oxygen and silica gel
Hideharu Seto, Shozo Fujioka, Suguru Takatsuto, Hiroyuki Koshino, Takeshi Shimizu, Shigeo Yoshida
Structure      13C NMR   碳谱模拟图

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39 .     (24R) 24-ethyl-6β-hydroperoxy-cholest-4-en-3-one
    相似度:83.3%
Natural Product Research          1994          5          7-14
Hydroperoxysterols in Arum italicum
Marina Della Greca; Antonio Fiorentino; Antonio Molinaro; Pietro Monaco; Lucio Previtera
Structure      13C NMR   碳谱模拟图

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40 .     (24R)24-ethyl-6α-hydroperoxy-cholest-4-en-3-one
    相似度:83.3%
Natural Product Research          1994          5          7-14
Hydroperoxysterols in Arum italicum
Marina Della Greca; Antonio Fiorentino; Antonio Molinaro; Pietro Monaco; Lucio Previtera
Structure      13C NMR   碳谱模拟图

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41 .     (24S)-24-ethyl-3-oxoholesta-4,25-dien-6β-ol
    相似度:83.3%
Journal of Natural Products          1995          Vol 58          1521-1526
Oxygenated Clerosterols Isolated from the Marine Alga Codium arabicum
Jyh-Horng Sheu, Chin-Chuang Liaw, Chang-Yih Duh
Structure      13C NMR   碳谱模拟图

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42 .     Stigmasta-4,22-diene-6β-ol-3-one
    相似度:83.3%
Chinese Journal of Marine Drugs          2009          28(3)          23-28
Sterols from the mangrove plant Acanthus ilicifolius
HAI Fang, T ANG Xu-li, LI Guo-qiang
Structure      13C NMR   碳谱模拟图

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43 .     stigmast-4-en-3β,6β-diol
    相似度:80%
China Journal of Chinese Materia Medica          2008          33          1035-1038
Study on Steroids of Cacalia tangutica
LIU Qing, LIU Zhenling, TIAN Xuan
Structure      13C NMR   碳谱模拟图

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44 .     ethylpavlovol
    相似度:80%
Fitoterapia          2005          76          433-438
A new dihydroxysterol from the marine phytoplankton Diacronema sp.
Amélia P. Rauter, Manuela M. Filipe, Carla Prata,João P. Noronha, Maria A.M. Sampayo,Jorge Justino,Jaime Bermejo
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

45 .     6β-hydroxy-stigmasta-4,22-dien-3-one
    相似度:80%
China Journal of Chinese Materia Medica          2011          Vol 36,Issue 7          891-895
Chemical constituents from petroleum ether portion of Abelmoschus esculentus
JIA Lu, GUO M ingm ing, LI Dong, JING Lin lin
Structure      13C NMR   碳谱模拟图

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46 .     3β,6β-stigmast-4-en-3,6-diol
C29H50O2     相似度:80%
Chinese Journal of Marine Drugs          2006          25(1)          21-24
Studies on chemical constituents of the marine sponge Craniell a australiensis from the South China Sea
KUANG Xia, ZHANG Hong-jun, SUN Jing-bo, WANG Zeng-lei, LIN Hou-wen
Structure      13C NMR   碳谱模拟图

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47 .     stigmast-4-en-3β,6β-diol
    相似度:80%
China Journal of Chinese Materia Medica          2010          35          1004-1008
Chemical constituents of a new species of Spongia sponge
GUAN Zhi*; ZENG Longmei
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

48 .     6α-hydroxy-cholest-4-ene-3-one
C27H44O2     相似度:80%
Bioorganic & Medicinal Chemistry Letters          2002          12          1715-1718
New ketosteroids from the red alga Hypnea musciformis
V. Bultel-Poncé, S. Etahiri, M. Guyot
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

49 .     3β,6β-stigmast-4-en-3,6-diol
    相似度:80%
Chinese Traditional and Herbal Drugs          2007          38          14-17
Chemical constituents of whole herb of Dicliptera chinensis
GAO Yu-tao; YANG Xiu-wei; AI Tie-min
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

50 .     stigmasta-4-en-3β,6β-diol
C29H50O2     相似度:80%
Chinese Traditional and Herbal Drugs          2006          37          831-833
玉米须的化学成分研究
徐燕;梁敬钰
Structure      13C NMR   碳谱模拟图

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51 .     stigmast-4-ene-3β,6β-diol
    相似度:80%
Chinese Journal of Natural Medicines          2009          7          425-427
Chemical Constituents from Houttuynia cordata
QU Wei; LIANG Jing-Yu; LI Meng-Ran
Structure      13C NMR   碳谱模拟图

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52 .     3β,6β-stigmast-4-en-3,6-diol
    相似度:80%
Chinese Journal of Natural Medicines          2009          7          115-118
Chemical Constituents from the Fruits of Ziziphus jujuba
GUO Sheng; TANG Yu-Ping; DUAN Jin-Ao; SU Shu-Lan; QIAN Da-Wei Jiangsu
Structure      13C NMR   碳谱模拟图

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53 .     compound 2
C29H46O2     相似度:80%
Pharmazie          2002          57          212-214
A new cytotoxic stigmastane steroid from Pistia stratiotes
S. N. Ayyad
Structure      13C NMR   碳谱模拟图

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54 .     compound 2
C29H46O2     相似度:80%
Pharmazie          2002          57          212-214
A new cytotoxic stigmastane steroid from Pistia stratiotes
S. N. Ayyad
Structure      13C NMR   碳谱模拟图

--------------------------------------------------------------------------------

55 .     β-Sitosterol acetate
    相似度:80%
Archives of Pharmacal Research          2005          28          1135-1141
Inhibitory effect on TNF-α-induced IL-8 production in the HT29 cell of constituents from the leaf and stem ofWeigela subsessilis
Phuong Thien Thuong, WenYi Jin, JongPill Lee, RackSeon Seong and Young-Mi Lee, et al.
Structure      13C NMR   碳谱模拟图
3楼2012-06-26 20:09:36
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引用回帖:
3楼: Originally posted by Keydream at 2012-06-26 20:09:36
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
12.2,12.3,19.0,19.3,19.8,20.1,21.3,23.4,24.2,24.4, ...

化合物2的碳谱数据打多了一个,麻烦帮我再查一次吧12.2,12.3,19.0,19.3,19.8,20.1,21.3,23.4,24.4,26.5,28.5,29.5,30.0,34.2,34.5,36.4,37.4,38.3,38.9,39.9,42.8,46.2,53.9,56.3,56.4,73.6,126.6,168.7,200.6
4楼2012-06-26 21:11:31
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