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化合物简介
5β-Cholestan-3-one is a metabolite of cholesterol and is used to asses the biosynthesis of cholesterol.
基本信息
CAS:601-53-6
中文别名:
英文别名:5beta-Cholestan-3-one;5B-Cholestan-3-one;cholestan-3-one;coprostanone;5beta-cholestan-3-one;5beta Cholestanone;Coprostan-3-one;(5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one;
分子式:C27H46O
分子量:386.654
精确质量:386.355
Psa:17.07
Logp:7.6768
中文别名:
英文别名:5beta-Cholestan-3-one;5B-Cholestan-3-one;cholestan-3-one;coprostanone;5beta-cholestan-3-one;5beta Cholestanone;Coprostan-3-one;(5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one;
分子式:C27H46O
分子量:386.654
精确质量:386.355
Psa:17.07
Logp:7.6768
编号系统
EINECS号:210-003-0
物化性质
密度:0.953 g/cm3
沸点:452.9ºC at 760 mmHg
闪点:219.3ºC
沸点:452.9ºC at 760 mmHg
闪点:219.3ºC
安全信息
生产方法及用途
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict

Mass spectrum (electron ionization)
