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化合物简介
A metabolite of Hydroxycholesterol and Hydroxysitosterol.
基本信息
CAS:1254-03-1
中文别名:
英文别名:7alpha,12alpha-Dihydroxycholest-4-en-3-one;CPD-7237;7,12-Dihydroxycholest-4-en-3-one;4-cholesten-7alpha,12alpha-diol-3-one;7alpha,12alpha-dihydroxy-4-cholesten-3-one;(7R,8R,9S,10R,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;7alpha,12alpha-dihydroxycholest-4-en-3-one;
分子式:C27H44O3
分子量:416.636
精确质量:416.329
Psa:57.53
Logp:5.5385
中文别名:
英文别名:7alpha,12alpha-Dihydroxycholest-4-en-3-one;CPD-7237;7,12-Dihydroxycholest-4-en-3-one;4-cholesten-7alpha,12alpha-diol-3-one;7alpha,12alpha-dihydroxy-4-cholesten-3-one;(7R,8R,9S,10R,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;7alpha,12alpha-dihydroxycholest-4-en-3-one;
分子式:C27H44O3
分子量:416.636
精确质量:416.329
Psa:57.53
Logp:5.5385
编号系统
物化性质
密度:1.07g/cm3
沸点:549.9ºC at 760mmHg
闪点:300.4ºC
折射率:1.542
蒸汽压:2.2E-14mmHg at 25°C
沸点:549.9ºC at 760mmHg
闪点:300.4ºC
折射率:1.542
蒸汽压:2.2E-14mmHg at 25°C
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
1H NMR : Predict

13C NMR : Predict
