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4-[(1E,3S,5Z,8R/S,10S)-3,11-二-{[叔-丁基(二甲基)硅烷基]氧基}-2,6,10-三甲基-8-(苯磺酰基)十一碳-1,5-二烯基]-2-甲基-1,3-噻唑
4-[(1E,3S,5Z,10S)-3,11-Bis{[dimethyl(2-methyl-2-propanyl)silyl]ox y}-2,6,10-trimethyl-8-(phenylsulfonyl)-1,5-undecadien-1-yl]-2-met hyl-1,3-thiazole
化合物简介
An intermediate in the synthesis of Epothilones. Epothilones are polyketide natural products that inhibit cancer cells by a mechanism similar to paclitaxel, and also are effective against paclitaxel-resistant tumours. Epothilone D is in phase I clinical testing of in patients with advanced solid tumours. Epothilone D is a cytotoxic macrolide that stabilises malignant cells' microtubules and arrests mitosis, a characteristic it shares with other epothilones. They bind to the same hepatic sites as does paclitaxel (Taxol) in a 1:1 stoichiometric ratio of a, b-tubulin heterodimers.
基本信息
CAS：308357-81-5
中文别名：
英文别名：4-[(1E,3S,5Z,8R/S,10S)-3,11-bis{[tert-butyl(dimethyl)silyl]oxy}-2,6,10-trimethyl-8-(phenylsulfonyl)undeca-1,5-dienyl]-2-methyl-1,3-thiazole;4-[(1-cyclopropylethyl)amino]-2-(trifluoromethyl)benzonitrile;Benzonitrile,4-[(1-cyclopropylethyl)amino]-2-(trifluoromethyl);
分子式：C36H61NO4S2Si2
分子量：692.175
精确质量：691.358
Psa：102.11
Logp：11.943
中文别名：
英文别名：4-[(1E,3S,5Z,8R/S,10S)-3,11-bis{[tert-butyl(dimethyl)silyl]oxy}-2,6,10-trimethyl-8-(phenylsulfonyl)undeca-1,5-dienyl]-2-methyl-1,3-thiazole;4-[(1-cyclopropylethyl)amino]-2-(trifluoromethyl)benzonitrile;Benzonitrile,4-[(1-cyclopropylethyl)amino]-2-(trifluoromethyl);
分子式：C36H61NO4S2Si2
分子量：692.175
精确质量：691.358
Psa：102.11
Logp：11.943
编号系统
物化性质
密度：1.027g/cm3
沸点：691.6ºC at 760 mmHg
闪点：372.1ºC
折射率：1.51
沸点：691.6ºC at 760 mmHg
闪点：372.1ºC
折射率：1.51
安全信息
生产方法及用途
合成路线
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参考文献
Mulzer, Johann; Mantoulidis, Andreas; Oehler, Elisabeth Journal of Organic Chemistry, 2000 , vol. 65, # 22 p. 7456 - 7467
上游原料
下游产品
图谱
1H NMR : Predict
13C NMR : Predict
