CAS: 65604-80-0; (2S,3R,4R,5R,6S)-2-(((2R,3R,4S,5R,6R)-5-Hydroxy-6-(Hydroxymethyl)-2-(((4S,5'R,6Ar,6Bs,8As,8Br,9S,10R,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,3',4,4',5,5',6,6A,6B,6',7,8,8A,8B,9,11A,12,12A,12B-Icosahydrospiro[naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Pyran]-4-yl)Oxy)-4-(((2S,3R,4S,5R)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-3-yl)Oxy)-6-Methyltetrahydro-2H-Pyran-3,4,5-Triol

该化合物是来自螺旋状类固醇框架的复杂胶质,其特点是一个具有独特螺旋形结构的螺旋体核心,其特征是具有独特的螺旋型结构,有助于其生物活动;多种糖浆的存在,包括6-deoxy-alpha-L-manopyranosyl, beta-D-xylophyranotisyl和 beta -D-gluoprophytranosyyl 单元,表明其分类为胶合体,表明它与生物系统可能发生相互作用,包括酶抑制或细胞路径调节;3Beta和25R组合所描述的立体化学学在确定该化合物的空间取向及其再活动性和生物功能方面发挥着关键作用;这些化合物经常因其药理学特性,包括防炎,抗癌症或免疫芳香效应而进行研究,从而使它们对医药化学和天然产品研究感兴趣.

英文名称(2S,3R,4R,5R,6S)-2-(((2R,3R,4S,5R,6R)-5-Hydroxy-6-(Hydroxymethyl)-2-(((4S,5'R,6Ar,6Bs,8As,8Br,9S,10R,11As,12As,12Bs)-5',6A,8A,9-Tetramethyl-1,3,3',4,4',5,5',6,6A,6B,6',7,8,8A,8B,9,11A,12,12A,12B-Icosahydrospiro[naphtho[2',1':4,5]Indeno[2,1-B]Furan-10,2'-Pyran]-4-yl)Oxy)-4-(((2S,3R,4S,5R)-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-3-yl)Oxy)-6-Methyltetrahydro-2H-Pyran-3,4,5-Triol
中文名称麦冬皂苷D
IUPAC名称(2S,3R,4R,5R,6S)-2-(((2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-(((4S,5'R,6aR,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-5',6a,8a,9-tetramethyl-1,3,3',4,4',5,5',6,6a,6b,6',7,8,8a,8b,9,11a,12,12a,12b-icosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-yl)oxy)-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol
其它别名Diosgenin 3-O-[alpha-L-rhamnopyranosyl-(1-2)][beta-D-xylopyranosyl-(1-3)]-beta-D-glucopyranoside
CAS编号65604-80-0
MFCD编号:MFCD09970543
分子式:C44H70O16分子量:855.03
产品CID: 1637832
产品分类生物化工 → 提取物 → 植物提取物

相似结构搜索
产品信息参考;;;;
InChIKey: DQYACEDUQHWXQZ-QOYNBSPSSA-N
InChI=1S/C44H70O16/c1-19-8-13-44(54-17-19)20(2)30-28(60-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,30)5)56-41-38(59-40-36(52)34(50)31(47)21(3)55-40)37(33(49)
计算化学: 氢键受体数16.0氢键供体数8.0可旋转键数7.0

物理性质

密度1.4±0.1 g/cm3
pKa:12.78±0.70(预测)
PSA:235.68
LogP:6.69
折射率1.618
溶解性Soluble In Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,Etc.
外观形态白色至类白色粉末
储存条件2-8°C
产品应用该化合物用作内容确定,识别和药理实验;针对人类肿瘤细胞线MG-63和SNU387(分别为IC50 = 3.09 ΜM和 3.63 微克M)的细胞毒性活动;以依赖剂量的方式启动SIRT1.

MSDS等安全信息

警示词Warning
危险描述H302-H315-H319-
防范说明P264-P270-P280-P301+P312+P330-P302+P352-P332+P313-P337+P313-P362+P364-P501-
安全声明H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body

上下游产品

合成工艺路线路线简述

📜2,3,4-Tri-O-Acetyl-L-Rhamnopyranosyl Trichloroacetimidate置于molecular Sieve,三氟化硼乙醚,Sodium Methylate,溶剂黄146体系中,用甲醇,二氯甲烷作为反应溶剂,化学反应生成麦冬皂苷d
参考文献:Chemical Synthesis Of Several 2'-O-,3'-O-Glycosylated Diosgenyl β-D-Glucopyranosides
标题:Chemical Synthesis Of Several 2'-O-,3'-O-Glycosylated Diosgenyl β-D-Glucopyranosides
摘要:Six 2'-O-,3'-O-Glycosylated Diosgenyl Beta-D-Glucopyranosides (4-9),Which Have A Typical Structural Pattern Of Diosgenyl Saponins,Were Synthesized; Their Synthetic Routes Are Discussed.
DOI:10.1080/07328309908544058

海关参考信息

2901210000-乙烯
2901220000-丙烯
2905122000-异丙醇
2905310000-1,2-乙二醇
💡 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

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✅ COA系统入驻 | 共享模式

合成参考文献

参考文献:10.1016/j.biochi.2018.04.022
摘要:Ma XY, Wen XX, Yang XJ, Zhou DP, Wu Q, Feng YF, Ding HJ, Lei W, Yu HL, Liu B, Xiang LB, Wang TS. Ophiopogonin D improves osteointegration of titanium alloy implants under diabetic conditions by inhibition of ROS overproduction via Wnt/β-catenin signaling pathway. Biochimie. 2018 Sep;152():31–42. doi: 10.1016/j.biochi.2018.04.022.