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[求助]
求助微谱数据库查一化合物
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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： 70.99,114.21,114.72,114.82,115.81,115.87,121.26,121.49,125.60,125.68,144.83,145.19,145.64,148.36,148.46,165.73,166.23,175.71 溶剂选项： CD3SOCD3 相似度： >=60% |
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火箭穿屁屁
木虫 (正式写手)
地球球长
- 应助: 197 (高中生)
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【答案】应助回帖
★ ★ ★ ★ ★ ★ ★ ★ ★ ★ ★
感谢参与，应助指数 +1
jiangchunyong: 金币+1, 谢谢 2012-08-20 09:37:01
cj考研: 金币+10, ★有帮助, 谢谢！ 2012-08-20 19:59:03
感谢参与，应助指数 +1
jiangchunyong: 金币+1, 谢谢 2012-08-20 09:37:01
cj考研: 金币+10, ★有帮助, 谢谢！ 2012-08-20 19:59:03
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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 70.99,114.21,114.72,114.82,115.81,115.87,121.26,121.49,125.60,125.68,144.83,145.19,145.64,148.36,148.46,165.73,166.23,175.71 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55个化合物(查询结果仅供参考) -------------------------------------------------------------------------------- 1 . 3,5-dicaffeoylquinic acid 相似度:78.2% Journal of Chemical Ecology 2004 30 589-606 A Flavanone and Two Phenolic Acids from Chrysanthemum morifolium with Phytotoxic and Insect Growth Regulating Activity Clifford W. Beninger, Mamdouh M. Abou-Zaid, Adrienne L. E. Kistner, Rebecca H. Hallett and Muhammad J. Iqbal, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 2 . 3,5-O-dicaffeoylquinic acid C25H24O12 相似度:77.2% China Journal of Chinese Materia Medica 2001 26 47-49 Studies on Chemical Constituents in Dried Buds of Lonicera similis Hemsl. LI Yongmei, WANG Tianzhi, WANG Zhixiao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 3 . teucrol 相似度:72.2% Phytochemistry 2000 55 927-931 Teucrol, a decarboxyrosmarinic acid and its 4'-O-triglycoside, teucroside from Teucrium pilosum Amani M.D. El-Mousallamy, Usama W. Hawas, Sahar A.M. Hussein Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 4 . caffeic acid 3,4-dihydroxyphenethyl ester C17H16O6 相似度:72.2% Journal of Natural Products 2010 73 252-254 Synthesis and Biological Evaluation of Caffeic Acid 3,4-Dihydroxyphenethyl Ester Zhizhen Zhang, Binghua Xiao, Qi Chen and Xiao-Yuan Lian Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 5 . rosemarinic acid 相似度:72.2% Journal of Shenyang Pharmaceutical University 2009 26 691-693 Isolation and identification of chemical constituents from stem and root of Ziziphora clinopodioides Lam. LI Ning, YANG Xiao-ju, MENG Da-li, LI Xian Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 6 . 3-methoxy-4-hrdroxyphenylpropyl caffeate C19H20O6 相似度:68.4% Acta Pharmaceutica Sinica 2007 Vol 42 621-624 Chemical constituents of Ligularia duciformis FU Kai-zhou; YU Neng-jiang; ZHANG Yang; ZHAO Yi-m Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 7 . (Z,E)-2-(3,4-dihydroxyphenyl)ethenyl ester C17H14O6 相似度:66.6% Chemical & Pharmaceutical Bulletin 1990 38 1772-1774 TWO NEW POTENT INHIBITORS OF XANTHINE OXIDASE FROM LEAVES OF PERILLA FRUTESCENS BRITTON VAR. ACUTA KUDO Tsutomu NAKANISHI,Masatoshi NISHI,Akira INADA,Hiroshi OBATA,Nobukazu TANABE,Shiro ABE and Michio WAKASHIRO Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 8 . 4,5-di-O-caffeoyl quinic acid 相似度:66.6% Natural Product Research 2009 23 1378-1383 A new acylated quercetin glycoside from the leaves of Stevia rebaudiana Bertoni Jun Li; Hua Jiang; Renbing Shi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 9 . rosmarinic acid 相似度:66.6% Chemical & Pharmaceutical Bulletin 1998 46 107-112 Constituents of Roots of Salvia deserta SCHANG. (Xinjiang-Danshen) Yasuhiro TEZUKA,Rena KASIMU,Jian Xin LI,Purusotam BASNET,Ken TANAKA,Tsuneo NAMBA and Shigetoshi KADOTA Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 10 . 3,3'-二乙氧基迷迭香酸(3,3'-Diethoxy rosmarinic acid) 相似度:66.6% Chemical Journal of Chinese Universities 2006 27 1292-1294 Studies on Antibacterial Constituents of Perillafru tescens GUO Qun-Qun, DU Gui-Cai, LI Rong-Gui, TENG Da-Wei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 11 . 迷迭香酸 C18H16O8 相似度:66.6% Chinese Traditional and Herbal Drugs 2010 41 29-32 草珊瑚的化学成分研究 段营辉; 戴毅; 高昊; 叶文才; 姚新生; Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 12 . α-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-3,4-dihydroxy-benzenepropanoic acid 相似度:66.6% Archives of Pharmacal Research 1997 20 291-296 Constituents of the herb of Isodon excisus var. coreanus Ho Kyoung Kim, Wan Kyunn Whang and Il Hyuk Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 13 . rosmarinic acid 相似度:66.6% Chinese Pharmaceutical Journal 2009 44 170-175 Bioactive Chemical Constituents from Tibetan Medicine Dracocephalum tanguticum Maxim. SHEN Jie, YE Yun-hua, ZHOU Ya-wei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 14 . rosmarinci acid C18H16O8 相似度:66.6% Journal of Shenyang Pharmaceutical University 2007 24 280-283 Chemical constituents of Rhodiola rosea L. and the inhibitiory effect on UV-induced A375-S2 cell death WANG Fang-yu, LI Dan, HAN Zhi-chao, GAO Hui-yuan, WU Li-jun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 15 . rosmarinic acid 相似度:66.6% Journal of Shenyang Pharmaceutical University 2006 23 425-426 Chemical constituents of the active parts of Mentha spicata L. (II) ZHENG Jian, GAO Hui-yuan, CHEN Guang-tong, YANG Xiao-ke, WU Bin, WU Li-jun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 16 . rosmarinic acid 相似度:66.6% Food Chemistry 2011 126 54-59 Assessment of in vitro antioxidant capacity of stem and leaf extracts of Rabdosia serra (MAXIM.) HARA and identification of the major compound Lianzhu Lin, Chun Cui, Lingrong Wen, Bao Yang, Wei Luo, Mouming Zhao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 17 . methyl rosmarinate 相似度:63.1% Chinese Chemical Letters 2000 11 997-1000 Depsides from Prunella vulgaris Zhu Ju WANG, Yu Ymg ZHAO, Bin WANG, Tie Mm AI, Ya Yan CHEN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 18 . methyl rosmarinate 相似度:63.1% China Journal of Chinese Materia Medica 2008 33 155-157 Studies on chemical constituents of Sarcandra glabra ZHU Lipinag, LI Yuan, YANG Jingzhi, ZUO Li, ZHANG Dongming Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 19 . 3,5-di-O-caffeoyl quinic acid 相似度:61.9% Korean Journal of Pharmacognosy 2003 34(2) 128-131 Chemical Constituents of Dipsacus asper (II) Kwon, Yong-Soo; Kim, Kwan-Oh; Lee, Jin-Hoon; Son, Soon-Ju; Won, Hee-Mok; Chang, Bok-Sim; Kim, Chang-Min Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 20 . chlorogenic acid C16H18O9 相似度:61.1% Chemical & Pharmaceutical Bulletin 1991 39 865-870 Studies on the Constituents of the Bark of Kalopanax pictus NAKAI Kazuko SANO,Shuichi SANADA,Yoshiteru IDA and Junzo SHOJI Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 21 . (Z,E)-2-(3,5-dihydroxyphenyl)ethenyl ester 相似度:61.1% Chemical & Pharmaceutical Bulletin 1990 38 1772-1774 TWO NEW POTENT INHIBITORS OF XANTHINE OXIDASE FROM LEAVES OF PERILLA FRUTESCENS BRITTON VAR. ACUTA KUDO Tsutomu NAKANISHI,Masatoshi NISHI,Akira INADA,Hiroshi OBATA,Nobukazu TANABE,Shiro ABE and Michio WAKASHIRO Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 22 . chlorogenic acid 相似度:61.1% Chemistry of Natural Compounds 2006 42 567-570 NEW THIAZINEDIONES AND OTHER COMPONENTS FROM Xanthium strumarium Ting Han, Huiliang Li, Qiaoyan Zhang,Hanchen Zheng, and Luping Qin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 23 . rosmarinic acid 相似度:61.1% Chinese Chemical Letters 2000 11 997-1000 Depsides from Prunella vulgaris Zhu Ju WANG, Yu Ymg ZHAO, Bin WANG, Tie Mm AI, Ya Yan CHEN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 24 . Chlorogenic acid C16H18O9 相似度:61.1% Molecules 2008 13 2796-2803 A New Phloroglucinol Diglycoside Derivative from Hypericum japonicum Thunb. Xiao W. Wang, Yu Mao, Nai-Li Wang and Xin S. Yao Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 25 . trans-caffeoylgluconic acid C15H18O10 相似度:61.1% Journal of Asian Natural Products Research 2008 10 759-763 Two new acylgluconic acids from the nearly ripe fruits of Evodia rutaecarpa Meng-Yao Zhao and Xiu-Wei Yang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 26 . davidioside B C15HI5O9 相似度:61.1% Natural Product Research 2008 22 471-476 New caffeoyl derivatives from the leaves of Davidia involucrata Ming-An Ouyang; Jian-Nin Zhou; Shi-Bin Wang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 27 . rosmarinic acid C18H16O8 相似度:61.1% Chemical & Pharmaceutical Bulletin 1999 47 1444-1447 Studies on the Constituents of Fruits of Helicteres isora L. Toshiko SATAKE,Kohei KAMIYA,Yasuhisa SAIKI,Takao HAMA,Yasuo FUJIMOTO,Susumu KITANAKA,Yumiko KIMURA,Jun UZAWA,Hanani ENDANG and Mansur UMAR Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 28 . 2-O-caffeoyl-3-(4-hydroxyphenyl) latic acid C18H16O7 相似度:61.1% Chemical & Pharmaceutical Bulletin 1999 47 1444-1447 Studies on the Constituents of Fruits of Helicteres isora L. Toshiko SATAKE,Kohei KAMIYA,Yasuhisa SAIKI,Takao HAMA,Yasuo FUJIMOTO,Susumu KITANAKA,Yumiko KIMURA,Jun UZAWA,Hanani ENDANG and Mansur UMAR Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 29 . 3,5-dicaffeoylquinic acid 相似度:61.1% Fitoterapia 2000 71 713-715 Constituents from Lonicera japonica Li-Yan Peng, Shuang-Xi Mei, Bei Jiang, Hong Zhou,Han-Dong Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 30 . 3,5-dicaffeoylquinic acid methyl ester 相似度:61.1% Fitoterapia 2000 71 713-715 Constituents from Lonicera japonica Li-Yan Peng, Shuang-Xi Mei, Bei Jiang, Hong Zhou,Han-Dong Sun Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 31 . 1S-3β-O-trans-caffeoyl-1α,4α,5β-trihydroxycyclohexane-1-carboxylic acid C16H18O9 相似度:61.1% Phytochemistry 1998 49 103-108 A Caffeoylcyclohexane-1-Carboxylic Acid Derivative From Asimina Triloba Meena Haribal, Paul Feeny, Cathy C. Lester Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 32 . chlorogenic acid 相似度:61.1% Korean Journal of Pharmacognosy 1998 29(2) 142-145 Phenolic Compound from Lepisorus thunbergianus Lee, Min-Won Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 33 . Chlorogenic acid 相似度:61.1% Archives of Pharmacal Research 2011 Vol 34, No 9 1561-1569 Inhibition of 5-Lipoxygenase and Skin Inflammation by the Aerial Parts of Artemisia capillaris and its Constituents Oh Song Kwon, Jae Sue Choi, Md. Nurul Islam, Yeong Shik Kim, and Hyun Pyo Kim Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 34 . 1-[(caffeoyloxy)(carboxy)methoxy]-1H-pyrrole-2,3,5-tricarboxylic acid 相似度:61.1% Phytochemistry 1990 29 3299-3301 Caffeoylmalic and two pyrrole acids from Parietaria officinalis Jaromir Budzianowski Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 35 . chlorogenic 相似度:61.1% Chinese Traditional and Herbal Drugs 2008 39 21-23 半枝莲化学成分的研究 仲浩;薛晓霞;姚庆强 Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 36 . 1-O-caffeoylquinic acid C16H18O9 相似度:61.1% Chinese Journal of Natural Medicines 2006 4 45-48 Chemical Constituents in Bud of Lonicera macranthoides XU Xiao-Fang; LI Hui-Jun; Li Ping; FENG Xu; YUAN Chang-Qi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 37 . Chlorogenic acid 相似度:61.1% Archives of Pharmacal Research 1999 22 213-218 Antioxidant flavonoids and chlorogenic acid from the leaves of Eriobotrya japonica Hyun Ah Jung, Jong Cheol Park, Hae Young Chung, Jong Kim and Jae Sue Choi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 38 . Rosmarinic acid C18H16O8 相似度:61.1% Guihaia 2010 30 887-890 Chemical constituents of Picria f el-terrae HUANG Yong-Lin, CHEN Yue-Yuan, WEN Yong-Xin, LI Dian-Peng, CHEN Wen-Juan, LIU Jin-Lei, LU Feng-Lai Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 39 . Chlorogenic acid 相似度:61.1% Natural Product Sciences 2010 16 20-25 Isolation of Phenolics, Nucleosides, Saccharides and an Alkaloid from the root of Aralia cordata Hyun, Sook-Kyung; Jung, Hyun-Ah; Min, Byung-Sun; Jung, Jee-H.; Choi, Jae-Sue Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 40 . Neochlorogenic acid 相似度:61.1% Natural Product Sciences 2010 16 20-25 Isolation of Phenolics, Nucleosides, Saccharides and an Alkaloid from the root of Aralia cordata Hyun, Sook-Kyung; Jung, Hyun-Ah; Min, Byung-Sun; Jung, Jee-H.; Choi, Jae-Sue Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 41 . chlorogenic acid 相似度:61.1% Chinese Pharmaceutical Journal 2005 40 1859-1861 Study on chemical constitutes of Smallanthus sonchifolius TAN Cheng-yu, HU Jian-en, WANG Huan-di, DU Yu-guang, BAI Xue-fang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 42 . chlorogenic acid C16H18O9 相似度:61.1% Journal of Shenyang Pharmaceutical University 2009 26 188-190 Isolation, identification and activity determination on the anti-hypoxic components of Hypericum japonicum Thunb. WANG Xiao-wei, MAO Yu, FAN Ming, DING A i-shi, WANG Nai-li, YAO Xin-sheng Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 43 . chlorogenic acid 相似度:61.1% Journal of Shenyang Pharmaceutical University 2006 23 568-569 Chemical constituents from the water-soluble part of Notopterygium incisum Ting ex H. T. Chang LIU Zhi-gang, REN Pei-pei, LI Fa-mei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 44 . rosmanic acid 相似度:61.1% Natural Product Research and Development 2008 20 262-264 Chemical Constituents of Glechoma longituba YU Zhi-bin; WU Xia; YE Yun-hua; ZHOU Ya-wei Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 45 . rosmarinic acid 相似度:61.1% Journal of the Chinese Chemical Society 1995 42 93-95 Chemical Components from Triumfetta bartramia 何禮剛(Li-Kang Ho);?埥∪�(Chiann-Rong Chang);?堄绖�(Yuan-Shiun Chang) Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 46 . chlorogenic acid 相似度:61.1% Journal of Chemical Ecology 2004 30 589-606 A Flavanone and Two Phenolic Acids from Chrysanthemum morifolium with Phytotoxic and Insect Growth Regulating Activity Clifford W. Beninger, Mamdouh M. Abou-Zaid, Adrienne L. E. Kistner, Rebecca H. Hallett and Muhammad J. Iqbal, et al. Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 47 . chlorogenic acid 相似度:61.1% Phytotherapy Research 1998 12 562-567 Flavonol monoglycosides isolated from the antiviral fractions of Persea americana (Lauraceae) leaf infusion A. P. de Almeida, M. M. F. S. Miranda, I. C. Simoni, M. D. Wigg, M. H. C. Lagrota and S. S. Costa Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 48 . chlorogenic acid 相似度:61.1% Turkish Journal of Chemistry 2001 25 93-97 The Isolation of Carboxylic Acids from the Flowers of Delphinium formosum NEDİME DÜRÜST, SEÇKİN ÖZDEN, ESRA UMUR, YAŞAR DÜRÜST, MUSTAFA KÜÇÜKİSLAMOĞLU Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 49 . (-)-N-[3',4'-Dihydroxy-(E)-cinnamoyl]-3-hydroxy-L-tyrosine 相似度:61.1% Journal of Agricultural and Food Chemistry 2005 53 5419-5428 Isolation, Structure Determination, Synthesis, and Sensory Activity of N-Phenylpropenoyl-l-amino Acids from Cocoa (Theobroma cacao) Timo Stark and Thomas Hofmann Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 50 . compound 1 相似度:61.1% Journal of Agricultural and Food Chemistry 1999 47 3963-3966 Phenolic Antioxidants from the Leaves of Corchorus olitorius L. Keiko Azuma, Masayoshi Nakayama, Masaji Koshioka, Katsunari Ippoushi, Yuichi Yamaguchi, Katsunari Kohata, Yuji Yamauchi, Hidekazu Ito, and Hisao Higashio Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 51 . 2-O-β-D-(6-O-gentisoylglucopyranosyl)gentisic acid C20H20O12 相似度:60% Chemistry of Natural Compounds 2009 45 182-186 TWO NOVEL PHENOLIC COMPOUNDSFROM Stenoloma chusanum AND THEIRANTIFUNGAL ACTIVITY Bingru Ren, Bing Xia, Weilin Li,Julan Wu, and Hanqing Zhang Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 52 . erigeside Ⅰ 相似度:60% Acta Botanica Sinica 2002 44 344-348 Glycosides from Erigeron breviscapus CHEN Bin, LI Bo-Gang, ZHANG Guo-Lin Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 53 . ethyl rosmarinate 相似度:60% Chinese Chemical Letters 2000 11 997-1000 Depsides from Prunella vulgaris Zhu Ju WANG, Yu Ymg ZHAO, Bin WANG, Tie Mm AI, Ya Yan CHEN Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 54 . ethyl rosmarinate 相似度:60% China Journal of Chinese Materia Medica 2008 33 155-157 Studies on chemical constituents of Sarcandra glabra ZHU Lipinag, LI Yuan, YANG Jingzhi, ZUO Li, ZHANG Dongming Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- 55 . 1-O-feruloyl-3-O-p-coumaroylglycerol C22H22O8 相似度:60% Modern Chinese Medicine 2009 11(6) 9-11 Chemical Constituents from the Stems of Asparagus officinalis Sun Zhouxuan, Huang Xuefeng, Kong Lingyi Structure 13C NMR 碳谱模拟图 -------------------------------------------------------------------------------- |
2楼2012-08-20 07:03:50