methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate 基本信息
CAS号 21059-42-7 分子式 C28H42O7
分子量 490.62900 精确质量 　490.29300
PSA 　95.97000 LogP 　5.13430
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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：
21059-42-7
3D弹球模型：
立即前往扯扯看
分子式：
C28H42O7
分子量：
490.62900
中文名称：
methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
英文名称：
methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
中文别名：
methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
英文别名：
methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate;
3alpha-Hydroxy-6-oxo-5alpha-cholan-24-oic acid methyl ester 3-acetate;
3|A-Hydroxy-6-oxo-5|A-cholan-24-oic acid methyl ester 3-acetate;
Methyl 3|A-acetoxy-6-oxo-5|A-cholanate;
5|A-Cholanic acid-3|A-ol-6-one 3-acetate methyl ester;
5alpha-Cholanic acid-3alpha-ol-6-one 3-acetate methyl ester;
Methyl 3alpha-acetoxy-6-oxo-5alpha-cholanate
精确分子量/精确质量：
490.29300
极性分子表面积/PSA：
95.97000
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。
EINECS：
244-184-2
InChI：
The Key: ZVEMQMLASDHXDY-JZJBTKOFSA-N

物化性质展开↓

密度：
1.16g/cm3
沸点：
594.5ºC at 760mmHg
闪点：
250.4ºC
折射率：
1.523
蒸汽压：
4.21E-14mmHg at 25°C

合成路线查看所有的合成路线

  • 21059-36-9

    3α-Ethoxycarbonyloxy-7α,12α-dihydroxy-5β-cholan-24-oic acid methyl ester

  • →

    ~82%

  • 21059-42-7

    methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

  • 21059-40-5

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

  • →

  • 21059-42-7

    methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

  • 81-25-4

    胆酸

  • →

  • 21059-42-7

    methyl (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy- 10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydr o-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

上下游相关产品

上游产品

更多

  • 21059-36-9

    3α-Ethoxycarbonyloxy-7α,12α-dihydroxy-5β-cholan-24-oic acid methyl ester

  • 1448-36-8

    胆酸甲酯

  • 81-25-4

    胆酸

  • 21059-40-5

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

下游产品

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  • 434-13-9

    石胆酸

  • 83-49-8

    猪去氧胆酸

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