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3-去甲基硫代秋水仙碱
N-[(7S)-3-hydroxy-1,2-dimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
化合物简介
A Thiocolchicine metabolite, used in therapy as an antitunor, antiinflammatory and immunosuppressive agent.
基本信息
CAS:87424-25-7
中文别名:
英文别名:N-((S)-3-Hydroxy-1,2-dimethoxy-10-methylmercapto-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamid;Acetamide,N-(5,6,7,9-tetrahydro-1,2-dimethoxy-3-hydroxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl)-,(S);3-Desmethylthiocolchicine;(S)-7-Acetylamino-3-hydroxy-1,2-dimethoxy-10-methylmercapto-6,7-dihydro-5H-benzo[a]heptalen-9-on;Colchicine,O(sup 3)-demethyl-10-thio;O(sup 3)-Demethyl-10-thiocolchicine;(S) N-[1,2-dimethoxy-3-hydroxy-10-methylthio-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl]-acetamide;3-demethylthiocolchicine;Acetamide,N-((7S)-5,6,7,9-tetrahydro-3-hydroxy-1,2-dimethoxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl);3-O-demethylthiocolchicine;N-[(7S)-3-hydroxy-1,2-dimethoxy-10-methylsulfanyl-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide;2-Demethylthio-colchicine;N-((S)-3-hydroxy-1,2-dimethoxy-10-methylsulfanyl-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamide;
分子式:C21H23NO5S
分子量:401.476
精确质量:401.13
Psa:110.16
Logp:3.6728
中文别名:
英文别名:N-((S)-3-Hydroxy-1,2-dimethoxy-10-methylmercapto-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamid;Acetamide,N-(5,6,7,9-tetrahydro-1,2-dimethoxy-3-hydroxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl)-,(S);3-Desmethylthiocolchicine;(S)-7-Acetylamino-3-hydroxy-1,2-dimethoxy-10-methylmercapto-6,7-dihydro-5H-benzo[a]heptalen-9-on;Colchicine,O(sup 3)-demethyl-10-thio;O(sup 3)-Demethyl-10-thiocolchicine;(S) N-[1,2-dimethoxy-3-hydroxy-10-methylthio-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl]-acetamide;3-demethylthiocolchicine;Acetamide,N-((7S)-5,6,7,9-tetrahydro-3-hydroxy-1,2-dimethoxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl);3-O-demethylthiocolchicine;N-[(7S)-3-hydroxy-1,2-dimethoxy-10-methylsulfanyl-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide;2-Demethylthio-colchicine;N-((S)-3-hydroxy-1,2-dimethoxy-10-methylsulfanyl-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamide;
分子式:C21H23NO5S
分子量:401.476
精确质量:401.13
Psa:110.16
Logp:3.6728
编号系统
物化性质
密度:1.33g/cm3
沸点:769ºC at 760 mmHg
熔点:>240ºC (dec.)
闪点:418.9ºC
折射率:1.636
储存条件:-20ºC Freezer
沸点:769ºC at 760 mmHg
熔点:>240ºC (dec.)
闪点:418.9ºC
折射率:1.636
储存条件:-20ºC Freezer
安全信息
生产方法及用途
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
