24小时热门版块排行榜    

查看: 748  |  回复: 6
当前只显示满足指定条件的回帖,点击这里查看本话题的所有回帖

慧子a

铁虫 (初入文坛)

[求助] 有化合物碳谱数据如下,求化合物结构式。求助求助,急急,在线等,谢谢!金币~~~~~~ 已有1人参与

有化合物碳谱如下:
1、溶剂为氘代甲醇207.35,137.20,126.87,109.48,99.22,83.29,75.53,75.03,74.81,72.43,69.17,61.62,60.28,53.49,49.42,36.71,36.28,35.81,35.42,34.44,30.60,28.01,26.48,21.69,20.74,20.34,16.66,14.66,12.65.。
2、183.61,67.44,57.00,55.31,50.75,44.97,44.75,43.68,41.66,40.77,39.62,38.11,37.86,31.38,29.01,22.41,19.12,18.89,15.58
3、212.26,207.35,136.05,127.97,74.89,63.13,61.58,53.25,51.83,49.18,48.16,42.83,42.24,35.84,34.32,30.25,27.99,24.85,21.04,20.24,16.83,13.90
回复此楼

» 猜你喜欢

» 本主题相关价值贴推荐,对您同样有帮助:

已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

yangyinhe

至尊木虫 (著名写手)

【答案】应助回帖

1 .     17-hydroxy-ent-atisan-19-oic acid
    相似度:85%
Helvetica Chimica Acta          2006          Vol. 89          1367
Further New Secoatisane Diterpenoids from the Chinese Mangrove Excoecaria agallocha L.
Ji-Dong Wang, Zhen-Yu Li, Wen-Sheng Xiang and Yue-Wei Guo
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

2 .     17-hydroxy-ent-atisan-19-oic acid
C20H32O3     相似度:85%
Helvetica Chimica Acta          2004          Vol. 87          758
Chemical Constituents from the Pericarp of Trewia nudiflora
Zhi-Zhi Du, Hong-Ping He, Bin Wu, Yue-Mao Shen, and Xiao-Jiang Hao
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

3 .     (-)-17-hydroxy-16α-kauran-19-oic acid
    相似度:85%
Journal of Natural Products          1999          62          1522-1525
Immunosuppressive Diterpenoids from Tripterygium wilfordii
Hongquan Duan, Yoshihisa Takaishi, Hiroshi Momota, Yasukazu Ohmoto, Takao, Taki, Yongfeng Jia, and Duan Li
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

4 .     siegesmethyletheric acid
C21H34O3     相似度:85%
Chinese Traditional and Herbal Drugs          1997          28          259-262
Studies on the Chemical Constituents of Glandularstalk St. Paulswort (Siegesbeckia pubescens)(Ⅰ)
Fu Hongzheng; Lou Zhicen; Yang Xiuwei; et al(National Laboratory of Natural arid Biomimetic Drugs; Beijing Medical University; Beijing);
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

5 .     17-hydroxy-16α-ent-kauran-19-oic acid
C20H32O3     相似度:85%
Archives of Pharmacal Research          2009          32          1369-1372
A new ent-kaurane type diterpenoid glycoside from Inula japonica Thunb.
Jiang Jiang Qin, Jia Xian Zhu, Wei Dong Zhang, Yan Zhu and Jian Jun Fu, et al.
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

6 .     对映-17-羟基贝壳杉烷-19-2羧酸
    相似度:85%
Chinese Pharmaceutical Journal          2006          41          1854-1857
Study on Chemical Constituents of Herba Siegesbeckiae
CHOU Gui-xin, WANG Zheng-tao
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

7 .     17-hydroxy-ent-atisan-19-oic acid methyl ester
C21H34O3     相似度:80.9%
Helvetica Chimica Acta          2004          Vol. 87          758
Chemical Constituents from the Pericarp of Trewia nudiflora
Zhi-Zhi Du, Hong-Ping He, Bin Wu, Yue-Mao Shen, and Xiao-Jiang Hao
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

8 .     17-hydroxy-16α-entkauran-19-oic acid
    相似度:80%
Journal of Natural Products          1996          59          635-637
Identification of ent-16β, 17-Dihydroxykauran-19-oic Acid as an Anti-HIV Principle and Isolation of the New Diterpenoids Annosquamosins A and B from Annona squamosa
Yang-Chang Wu, Yu-Chun Hung, Fang-Rong Chang, Mark Cosentino, Hui-Kang Wang, and Kuo-Hsiung Lee
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

9 .     ent-16αH,17-hydroxy-kauran-19-oic acid
C20H32O3     相似度:80%
Phytochemistry          1992          31          917-921
Diterpenoids from Siegesbeckia pubescens
Jiang Xiong, Yunbao Ma, Yunlong Xu
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

10 .     (16R)-17-hydroxy-ent-kauran-19-oic acid
C20H32O3     相似度:80%
Chemical & Pharmaceutical Bulletin          2010          58          765-768
Four New ent-Kaurane Diterpenoids from the Fruits of Annona cherimola
Hiroyuki Miyashita, Makiko Nishida, Masafumi Okawa, Toshihiro Nohara and Hitoshi Yoshimitsu
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

11 .     compound 2
    相似度:80%
Chinese Pharmaceutical Journal          2003          38          258-260
Studies on the chemical constituents of Annona glabra
6楼2015-03-21 18:26:04
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
查看全部 7 个回答

慧子a

铁虫 (初入文坛)

引用回帖:
3楼: Originally posted by yangyinhe at 2015-03-21 14:13:14
格式不对

1、12.65,14.66,16.66,20.34,20.74,21.69,26.48,28.01,30.60,34.44,35.42,35.81,36.28,36.71,49.42,53.49,60.28,61.62,69.17,72.43,74.81,75.03,75.53,83.29,99.22,109.48,126.87,137.20,207.35
2、15.58,18.89,22.41,29.01,31.38,37.86,38.11,39.62,40.77,41.66,43.68,44.75,44.97,50.75,55.31,57.00,67.44,183.61
3、13.90,16.83,20.24,21.04,24.85,27.99,30.25,34.3,35.842,42.24,42.83,48.16,49.18,51.83,53.25,61.58,63.13,74.89,127.97,136.05,207.35,212.26
4楼2015-03-21 16:36:44
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

yangyinhe

至尊木虫 (著名写手)

【答案】应助回帖

★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与,应助指数 +1
慧子a(卓越_先锋代发): 金币+30, ok 2015-04-02 15:08:42
1 .     (25S)-5α-Spirost-23-ene-3β,25-diol 3-acetate
C29H44O5     相似度:62.0%
Steroids          2008          73          449-457
Synthesis of “glycospirostanes”—Steroid sapogenins with a sugar-like ring F
Yliana López, Izabella Jastrzębska, Rosa Santillan, Jacek W. Morzycki
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

2 .     compound 1b
    相似度:60%
Tetrahedron Letters          2008          49          3405-3408
A new taxane composed of two N-formyl rotamers from Taxus canadensis
Man-Li Zhang, Mei Dong, Xiao-Ning Li, Li-Geng Li, Fançoise Sauriol, Chang-Hong Huo, Qing-Wen Shi, Yu-Cheng Gu, Hiromasa Kiyota, Bin Cong
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

3 .     Nebrosteroid E
C28H46O3     相似度:58.6%
Steroids          2008          73          1181-1186
New anti-inflammatory 4-methylated steroids from the Formosan soft coral Nephthea chabroli
Ya-Ching Huang, Zhi-Hong Wen, Shang-Kwei Wang, Chi-Hsin Hsu, Chang-Yih Duh
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

4 .     (23S,24S,25R)-5α-Spirostane-3β,23,24,25-tetraol 3-acetate
C29H46O7     相似度:58.6%
Steroids          2008          73          449-457
Synthesis of “glycospirostanes”—Steroid sapogenins with a sugar-like ring F
Yliana López, Izabella Jastrzębska, Rosa Santillan, Jacek W. Morzycki
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

5 .     (23R,24R,25S)-3β-acetoxy-24-chloro-5α-spirostane-23,3β-diol
C29H45ClO5     相似度:58.6%
Steroids          2009          74          675-683
On reactions of steroidal 23-oxo and 23,24-epoxysapogenins with Lewis acids
Izabella Jastrzębska, Leszek Siergiejczyk, Aneta M. Tomkiel, Zofia Urbańczyk-Lipkowska, Dominik Wójcik, Jacek W. Morzycki
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

6 .     3β,6α-diacetoxy-spirostane sapogenin
    相似度:58.6%
Phytochemistry          1982          21          2083-2085
Solanolide, a steroid lactone sapogenin from Solanum hispidum
Ajit K. Chakravarty, Binayak Das, Satyesh C. Pakrashi
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

7 .     Testosterone cis-non-4-enoate
C28H42O3     相似度:58.6%
Steroids          1990          55          36-39
Long-acting contraceptive agents: testosterone esters of unsaturated acids
C. G. Francisco, R. Freire, J. Gawronski, R. Hernández, M. Kielczewski, J. A. Salazar, F. Savabi, A. Shafiee, L. Strekowski, E. Suárez
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

8 .     solanogantamine N,O-diacetate
    相似度:58.0%
Indian Journal of Chemistry Section B          1988          27B          311-313
Confirmation of Structure of Isosolacapine:Stereochemistry at Ring Juncture of Indolizidine Moiety of 22βH Solanidanes by 13C & 1H NMR Spectroscopy
AJIT K CHAKRAVARTY & SATYESH C PAKRASHI
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

9 .     compound 2a
    相似度:57.5%
Canadian Journal of Chemistry          1981          59          1328-1330
13C nuclear magnetic resonance spectra of 23-hydroxy spirostane sapogenins of Solanum hispidum
Ajit K. Chakravarty, Satyesh C. Pakrashi, Jun Uzawa
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

10 .     (20R,23R,25R)-12β,23-Dihydroxy-22-oxo-5α-cholesta-3β,16β,26-triyl triacetate
C33H52O9     相似度:57.5%
Steroids          2013          78          902-908
Synthetic pathway to 22,23-dioxocholestanic chain derivatives and their usefulness for obtaining brassinosteroid analogues
Víctor Gómez-Calvario, Ailed Arenas-González, Socorro Meza-Reyes, Sara Montiel-Smith, José Luis Vega-Báez, Jesús Sandoval-Ramírez, María Guadalupe Hernández-Linares
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
5楼2015-03-21 18:21:07
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖

yangyinhe

至尊木虫 (著名写手)

【答案】应助回帖

1 .     E-salignone
    相似度:68.1%
Chemistry of Natural Compounds          2014          50          697-701
Synthesis and Antimetastatic Effect of E-salignone
Jia Liu, Sheng-Nan Ma, Xiang Zhang, Mei-Na Jin, Mei-Hua Jin, Dexin Kong, Nan Qin, Hong-Quan Duan
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

2 .     ethylenedithioketal
C19H28S4     相似度:59.0%
Journal of Natural Products          2004          67          189-193
Preparation of Moreliane-Derived Volatile Sesquiterpenes
Carlos M. Cerda-Garca-Rojas, Mara A. Bucio, Luisa U. Romn, Juan D. Hernndez, and Pedro Joseph-Nathan
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

3 .     E-salignone
    相似度:59.0%
Natural Product Research          1998          11          81-91
Three New Steroidal Amines from Sarcococca saligna
Atta-ur-rahman; M. Iqbal Choudhary; M. Riaz Khan; M. Zafar Iqbal
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

4 .     compound 2
    相似度:59.0%
Phytochemistry          1995          38          663-666
Labdane diterpenes from Halimium viscosum
Julio G. Urones, Isidro S. Marcos, Isabel M. Oliva, Narciso M. Garrido, Jane Hagget, Vanessa M. Humphreys
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

5 .     3β-Acetoxy-7β-hydroxy-5α-androstan-17-one
C21H32O4     相似度:59.0%
Steroids          2011          76          28-30
Synthesis of 7-hydroxy-epiandrosterone
Christophe Ricco, Gilbert Revial, Clotilde Ferroud,Olivier Hennebertb, Robert Morfin
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

6 .     7-monoketal
    相似度:59.0%
Tetrahedron Letters          2002          43          9559-9560
Synthesis and preliminary odour evaluation of 5α-androst-16-en-7-one: a new androstenone analogue
John A.S. Adams, Scott Clunas, Alan B. Turner
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

7 .     16α,17α-epoxy-5α-androstan-3-one
C19H28O2     相似度:59.0%
Journal of Chemical Research          2008          32          314-317
Microbiological hydroxylation of some epoxy steroids by the fungus Mucor plumbeus
Author: Alfooty, Khalid O.
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

8 .     fusarisetin A
C22H31NO5     相似度:59.0%
Journal of the American Chemical Society          2011          132          6865-6867
Fusarisetin A, an Acinar Morphogenesis Inhibitor from a Soil Fungus, Fusarium sp. FN080326
Jae-Hyuk Jang, Yukihiro Asami, Jun-Pil Jang, Sun-Ok Kim, Dong Oh Moon, Kee-Sun Shin, Daisuke Hashizume, Makoto Muroi, Tamio Saito, Hyuncheol Oh, Bo Yeon Kim, Hiroyuki Osada, and Jong Seog Ahn
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

9 .     fusarisetin A
C22H31NO5     相似度:59.0%
Journal of the American Chemical Society          2012          132          7194-7194
Correction to Fusarisetin A, an Acinar Morphogenesis Inhibitor from a Soil Fungus, Fusarium sp. FN080326
Jae-Hyuk Jang, Yukihiro Asami, Jun-Pil Jang, Sun-Ok Kim, Dong Oh Moon, Kee-Sun Shin, Daisuke Hashizume, Makoto Muroi, Tamio Saito, Hyuncheol Oh, Bo Yeon Kim, Hiroyuki Osada, and Jong Seog Ahn
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图

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

10 .     19-acetyl-4-hydroxydictyodiol
C22H36O4     相似度:59.0%
Journal of Natural Products          2014          77          2685-2693
Diterpenes from a Chinese Collection of the Brown Alga Dictyota plectens
Shimiao Cheng, Min Zhao, Zhongmin Sun, Weiping Yuan, Shuangshuang Zhang, Zheng Xiang, Yuepiao Cai, Jianyong Dong, Kexin Huang, and Pengcheng Yan
Structure      13C NMR    Structure & 13C NMR     碳谱模拟图
7楼2015-03-21 18:28:45
已阅   回复此楼   关注TA 给TA发消息 送TA红花 TA的回帖
信息提示
请填处理意见