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化合物简介
Pregnanolone (3α-hydroxy-5β-pregnan-20-one or 3α,5β-tetrahydroprogesterone; sometimes abbreviated as 3α,5β-THP), also known as eltanolone (INN), is an endogenous neurosteroid that is biosynthesized from progesterone. It is a positive allosteric modulator of the GABAA receptor, as well as a negative allosteric modulator of the glycine receptor, and is known to have sedative, anxiolytic, anesthetic, and anticonvulsant effects. It was investigated for clinical use as a general anesthetic, but produced unwanted side effects such as convulsions on occasion, and for that reason was never marketed.
基本信息
CAS:128-20-1
中文别名:5α-孕(甾)烷-3β-醇-20-酮;3α-羟基-5β-孕(甾)烷-20-酮;乙他诺隆;
英文别名:Pregnanolone II;5-Pregnan-3-ol-20-one;pregnanalone;Pregnan-20-one, 3-hydroxy-, (3α,5β)-;PREGNAN-3A-OL-20-ONE;3alpha-hydroxy-5beta-pregnan-20-one;Pregnan-20-one,3-hydroxy-, (3a,5b)-;Butabindide oxalate;
分子式:C21H34O2
分子量:318.493
精确质量:318.256
Psa:37.3
Logp:4.5952
中文别名:5α-孕(甾)烷-3β-醇-20-酮;3α-羟基-5β-孕(甾)烷-20-酮;乙他诺隆;
英文别名:Pregnanolone II;5-Pregnan-3-ol-20-one;pregnanalone;Pregnan-20-one, 3-hydroxy-, (3α,5β)-;PREGNAN-3A-OL-20-ONE;3alpha-hydroxy-5beta-pregnan-20-one;Pregnan-20-one,3-hydroxy-, (3a,5b)-;Butabindide oxalate;
分子式:C21H34O2
分子量:318.493
精确质量:318.256
Psa:37.3
Logp:4.5952
编号系统
MDL号:MFCD00067137
PubChem号:24898909
RTECS号:TU4384000
PubChem号:24898909
RTECS号:TU4384000
物化性质
外观与性状:固体
密度:1.05 g/cm3 (20ºC)
沸点:431.2ºC at 760 mmHg
熔点:149ºC
折射率:1.524
稳定性:Stable at normal temperatures and pressures.
储存条件:Keep tightly closed. Store in a cool dry place.
蒸汽压:3.05E-09mmHg at 25°C
密度:1.05 g/cm3 (20ºC)
沸点:431.2ºC at 760 mmHg
熔点:149ºC
折射率:1.524
稳定性:Stable at normal temperatures and pressures.
储存条件:Keep tightly closed. Store in a cool dry place.
蒸汽压:3.05E-09mmHg at 25°C
安全信息
安全说明:S22; S36
危险类别码:R40
危险品标志:Xn
信号词:Warning
危险性防范说明:P281
危险性描述:H351
危险标志:GHS08
危险类别码:R40
危险品标志:Xn
信号词:Warning
危险性防范说明:P281
危险性描述:H351
危险标志:GHS08
生产方法及用途
用途
激素类药。
激素类药。
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
