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

(4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid 基本信息
CAS号 15173-30-5 分子式 C24H38O5
分子量 406.55600 精确质量 　406.27200
PSA 　94.83000 LogP 　3.65690
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目录
基本信息 物化性质 合成路线 上下游

基本信息 展开↓

CAS号：
15173-30-5
3D弹球模型：
立即前往扯扯看
分子式：
C24H38O5
分子量：
406.55600
中文名称：
(4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
英文名称：
(4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
中文别名：
(4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
英文别名：
(4R)-4-[(3R,5R,8S,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid;
Methyl 3alpha,12alpha-dihydroxy-7-oxo-5beta-Cholan-24-oate;
Methyl-7-keto-3a,12a-dihydroxy-5b-cholanoate;
5beta-Cholan-24-oic acid,3alpha,12alpha-dihydroxy-7-oxo-,methyl ester;
methyl 7-oxodeoxycholate
精确分子量/精确质量：
406.27200
极性分子表面积/PSA：
94.83000
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: DBKCKIVBUXCUCX-BOUFHLEDSA-N

物化性质展开↓

密度：
1.18g/cm3
沸点：
583ºC at 760mmHg
闪点：
320.4ºC
折射率：
1.55
蒸汽压：
5.08E-16mmHg at 25°C

合成路线查看所有的合成路线

  • 83-44-3

    去氧胆酸

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  • 15173-30-5

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

  • 5130-29-0

    12-Ketolithocholic acid

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  • 108-24-7

    乙酸酐

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  • 15173-30-5

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

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  • 5130-29-0

    12-Ketolithocholic acid

  • 108-24-7

    乙酸酐

  • 83-44-3

    去氧胆酸

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  • 434-13-9

    石胆酸

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