CAS: 54928-05-1; (2S,4Ar,6As,6Br,8Ar,9R,10S,12Ar,12Br,14Bs)-10-Hydroxy-9-(Hydroxymethyl)-2-(Methoxycarbonyl)-2,6A,6B,9,12A-Pentamethyl-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid

该化合物是一种三元素化合物,产自菲律宾人种的植物,具有显著的生物活动,包括抗炎,抗病毒和抗菌素特性,使其成为药物学研究的热点.从结构上讲,它属于以C-30的碳信箱基组为特征的单体型三元素,这增强了其生物活动.研究显示它具有调节免疫反应和抑制病毒复制的潜力.其自然来源和多方面的治疗效应使它成为药物开发进一步调查的有希望的候选对象.HPLC和NMR等分析方法通常用于确保其纯度和结构核查.

英文名称(2S,4Ar,6As,6Br,8Ar,9R,10S,12Ar,12Br,14Bs)-10-Hydroxy-9-(Hydroxymethyl)-2-(Methoxycarbonyl)-2,6A,6B,9,12A-Pentamethyl-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid
中文名称美商陆酸
IUPAC名称(2S,4aR,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-10-hydroxy-9-(hydroxymethyl)-2-(methoxycarbonyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
其它别名Phytolaccagenic Acid; (4R,20S)-3β,23-Dihydroxyolean-12-Ene-28,29-Dioic Acid 29-Methyl Ester; (3Beta,4Alpha,20Beta)-3,23-Dihydroxy-Olean-12-Ene-28,29-Dioic Acid 29-Methyl Ester; Olean-12-Ene-28,29-Dioicacid, 3,23-Dihydroxy-, 29-Methyl Ester, (3B,4A,20B)-; Olean-12-Ene-28,29-Dioic Acid, 3,23-Dihydroxy-, 29-Methyl Ester, (3β,4α,20β)-; (2S,4Ar,6As,6Br,8Ar,9R,10S,12Ar,12Br,14Bs)-10-Hydroxy-9-(Hydroxymethyl)-2-(Methoxycarbonyl)-2,6A,6B,9,12A-Pentamethyl-1,2,3,4,4A,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Icosahydropicene-4A-Carboxylic Acid; Phytolaccagenic Acid Usp/ep/bp; Phytoaccigenic Acid
CAS编号54928-05-1
MFCD编号:MFCD02259455
FDA UNII编号:4L8N263YKD
分子式:C31H48O6分子量:516.72
产品CID: 2512372
产品分类生物化工

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产品信息参考;;;;
InChIKey: YAGYBNOEVSEGSL-HGDAMUQJSA-N
InChI=1S/C31H48O6/c1-26(25(36)37-6)13-15-31(24(34)35)16-14-29(4)19(20(31)17-26)7-8-22-27(2)11-10-23(33)28(3,18-32)21(27)9-12-30(22,29)5/h7,20-23,32-33H,8-18H2,1-6H3,(H,34
计算化学: 氢键受体数6.0氢键供体数3.0可旋转键数4.0

MSDS等安全信息

合成工艺路线路线简述

📜3-O-β-D-Glucopyranosylphytolaccagenic Acid 28-O-β-D-Glucopyranosyl Ester,水,盐酸反应生成美商陆酸
参考文献:Bandara,B. M. Ratnayake;Jayasinghe,Lalith;Karunaratne,Veranja;Wannigam+,Phytochemistry,28,(1989) N0,C. 2783-2785
标题:Bandara,B. M. Ratnayake;Jayasinghe,Lalith;Karunaratne,Veranja;Wannigam+,Phytochemistry,28,(1989) N0,C. 2783-2785

海关参考信息

2901210000-乙烯
2901220000-丙烯
2905122000-异丙醇
2905399001-1,3-丙二醇
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合成参考文献

参考文献:10.1126/science.1174621
摘要:Lingwood D, Simons K. Lipid rafts as a membrane-organizing principle. Science. 2010 Jan 01;327(5961):46–50. doi: 10.1126/science.1174621.