methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate 基本信息
CAS号 10538-64-4 分子式 C25H40O5
分子量 420.58200 精确质量  420.28800
PSA  83.83000 LogP  3.74530

等价的CAS号:

10538-64-4,71837-86-0,81644-37-3,81655-85-8,110655-76-0,110655-77-1,110655-78-2,110674-06-1

基本信息 展开↓

CAS号:
10538-64-4
3D弹球模型:
立即前往扯扯看
分子式:
C25H40O5
分子量:
420.58200
英文名称:
methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
英文别名:
methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate;
5beta-Cholan-24-oic acid,3alpha,7alpha-dihydroxy-12-oxo-,methyl ester;
Methyl 3alpha,7alpha-dihydroxy-12-oxo-5beta-Cholan-24-oate
精确分子量/精确质量:
420.28800
极性分子表面积/PSA:
83.83000
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: LGWDBNNCYKGKFM-DFAIRORGSA-N

合成路线查看所有的合成路线

  • 7727-82-4

    5-Beta-胆甾烷酸-3,7,12-三酮甲酯

  • ~75%

  • 10538-64-4

    methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

  • 186581-53-3

    重氮甲烷

  • +

  • 2458-08-4

    3α,7α-二羟基-12-羰基-5β-胆烷酸

  • 10538-64-4

    methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

  • 186581-53-3

    重氮甲烷

  • +

  • 186649-58-1

    186649-58-1

  • 10538-64-4

    methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate

  • +

  • 3057-04-3

    鹅脱氧胆酸甲酯

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    5-Beta-胆甾烷酸-3,7,12-三酮甲酯

  • 1448-36-8

    胆酸甲酯

  • 151112-03-7

    (3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-17-((R)-5-methoxy-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl dodecanoate

  • 186649-57-0

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    鹅脱氧胆酸甲酯

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