((2R,3S,4S,5R,6S)-6-(((2R,3R,4S,5S,6R)-2-(((3S,8R,10R,12R,13R,14R)-17-((S)-2-(((2S,3R,4S,5S,6R)-6-((((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-6-methylhept-5-en-2-yl)-12-hydroxy-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl methyl malonate

((2R,3S,4S,5R,6S)-6-(((2R,3R,4S,5S,6R)-2-(((3S,8R,10R,12R,13R,14R)-17-((S)-2-(((2S,3R,4S,5S,6R)-6-((((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-6-methylhept-5-en-2-yl)-12-hydroxy-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl methyl malonate 基本信息
CAS号 88140-43-6 分子式 C57H94O25
分子量 1179.34000 精确质量  1178.61000
PSA  389.43000 LogP  -1.44950

基本信息 展开↓

CAS号:
88140-43-6
3D弹球模型:
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分子式:
C57H94O25
分子量:
1179.34000
英文名称:
((2R,3S,4S,5R,6S)-6-(((2R,3R,4S,5S,6R)-2-(((3S,8R,10R,12R,13R,14R)-17-((S)-2-(((2S,3R,4S,5S,6R)-6-((((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-6-methylhept-5-en-2-yl)-12-hydroxy-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl methyl malonate
英文别名:
((2R,3S,4S,5R,6S)-6-(((2R,3R,4S,5S,6R)-2-(((3S,8R,10R,12R,13R,14R)-17-((S)-2-(((2S,3R,4S,5S,6R)-6-((((2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-6-methylhept-5-en-2-yl)-12-hydroxy-4,4,8,10,14-pentamethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl methyl malonate
精确分子量/精确质量:
1178.61000
极性分子表面积/PSA:
389.43000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: OFTSGLKMQFMCTP-HPWHQKKYSA-N

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