CAS: 786593-06-4; 4-(((1R,2R,4Ar,5R,8As)-2-((3-Carboxypropanoyl)Oxy)-1,4A-Dimethyl-6-Methylene-5-((E)-2-(2-Oxo-2,5-Dihydrofuran-3-yl)Vinyl)Decahydronaphthalen-1-yl)Methoxy)-4-Oxobutanoic Acid

该化合物是一种复杂的有机化合物,其特征是复杂的立体化学化学和功能组,它具有多个手动中心,有助于其特定的三维安排和潜在的生物活动. 氨酸基质的出现表明它能够参与氢的结合,并可能表现出极溶剂中的溶性.化合物还含有一个氯酮功能组,表明各种化学变异性.其结构包括多环和生物化学和生物化学特性.

英文名称4-(((1R,2R,4Ar,5R,8As)-2-((3-Carboxypropanoyl)Oxy)-1,4A-Dimethyl-6-Methylene-5-((E)-2-(2-Oxo-2,5-Dihydrofuran-3-yl)Vinyl)Decahydronaphthalen-1-yl)Methoxy)-4-Oxobutanoic Acid
中文名称脱水穿心莲内酯琥珀酸半酯
IUPAC名称4-(((1R,2R,4aR,5R,8aS)-2-((3-carboxypropanoyl)oxy)-1,4a-dimethyl-6-methylene-5-((E)-2-(2-oxo-2,5-dihydrofuran-3-yl)vinyl)decahydronaphthalen-1-yl)methoxy)-4-oxobutanoic acid
其它别名Dehydroandrographolidesuccinate ; 4-(((1R,2R,4Ar,5R,8As)-2-((3-Carboxypropanoyl)Oxy)-1,4A-Dimethyl-6-Methylene-5-((E)-2-(2-Oxo-2,5-Dihydrofuran-3-yl)Vinyl)Decahydronaphthalen-1-yl)Methoxy)-4-Oxobutanoic Acid ; 14-Deoxy-11,12-Dehydroandrographolide Succina
CAS编号786593-06-4
MFCD编号:MFCD10566633
FDA UNII编号:0X50BP49M1
分子式:C28H36O10分子量:532.59
产品CID: 1781120
产品分类分析化学 → 标准品 → 中药标准品

相似结构搜索
InChIKey: YTHKMAIVPFVDNU-GPTWTFMPSA-N
InChI=1S/C28H36O10/c1-17-4-7-20-27(2,19(17)6-5-18-13-15-36-26(18)35)14-12-21(38-25(34)11-9-23(31)32)28(20,3)16-37-24(33)10-8-22(29)30/h5-6,13,19-21H,1,4,7-12,14-16H2,2-3H
计算化学: 氢键受体数10.0氢键供体数2.0可旋转键数13.0

MSDS等安全信息

警示词Warning
危险描述H302-H315-H319-H335-
防范说明P261-P305+P351+P338-
危险品标志Xi
安全声明H303 may be harmful by ingestion +h313 may be harmful by skin contact +h2413 may be harmful by inhalation

上下游产品

CAS号108-30-5 丁二酸酐

合成工艺路线路线简述

📜Andrographolide,丁二酸酐置于三乙胺体系中,用乙酸乙酯作为反应溶剂,化学反应 8.0H,以93.4%的收率获得产物脱水穿心莲内酯琥珀酸半酯
参考文献:一种穿琥宁的制备方法
标题:一种穿琥宁的制备方法
摘要:本发明公开了一种穿琥宁的制备方法,包括脱水穿心莲内酯二琥珀酸半酯的粗制步骤,脱水穿心莲内酯二琥珀酸半酯的纯制步骤和穿琥宁制备步骤.本发明的制备方法操作简单,安全性高,毒性小,在常压下能够很容易地得到穿琥宁,保证了产品质量,成本低且适合工艺化生产.

海关参考信息

2901210000-乙烯
2901220000-丙烯
2901241000-1,3-丁二烯
2905122000-异丙醇
💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:CN-105541766-B
优先权日:2015-12-16
标题:A class of sulfur-containing andrographolide derivatives, its pharmaceutical composition, synthesis method and application

专利号:CN-103113331-A
优先权日:2013-02-28
标题 :Synthesis method of Yanhuning

其他信息查阅

供应商参考报价(招募中)

品牌试剂参考报价(招募中)

实用工具

📌 第三方产品分析报告

✅ COA系统入驻 | 共享模式

主要参考文献

参考标题:Efficient Acylation And One-Pot Synthesis Of Dehydroandrographolide Succinate On A Large Scale Assisted With Microwave Radiation
作者:Xin-Feng Luo,Ling He,Hai-Bin Yin,Hu Zheng,Di Bei,Jin-Jin Deng,Wen-Cai Huang |发布日期:2009.9.8
摘要:A Rapid And Convenient Method For Acylation And Large-Scale Synthesis Of Dehydroandrographolide Succinate Has Been Developed Under Microwave Irradiation. It Is A One-Pot Condensation And Is Compatible With Dehydration And Rearrangement Of Double Bond In Mild Reaction Conditions With Good Yield, High Purity (Up To 99.8%), Time-Savings, Few Pollutants And Low Cost. In Addition, A Number Of Acylation Derivatives Were Synthesized Under Microwave Irradiation.