Allopregnanolone 5α-孕甾-3α-醇-20-酮
CAS 516-54-1 MFCD00003677
化学结构图
SMILES: CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C
化学属性
| Mol. Formula | C21H34O2 |
|---|---|
| Mol. Weight | 318 |
| Solubility | chloroform: 20 mg/mL, clear, colorless |
别名和识别编码
| Chemical Name | Allopregnanolone |
|---|---|
| CAS Number | 516-54-1 |
| Synonym | 3α-Hydroxy-5α-pregnan-20-one 3α-OH-DHP Allopregnan-3α-ol-20-one Allopregnanolone ALLOPREGNAN-3ALPHA-OL-20-ONE Allotetrahydroprogesterone 3-alpha,5-alpha-Tetrahydroprogesterone 5α-Pregnan-3α-ol-20-one 3-alpha-Hydroxy-5-alpha-pregnan-20-one 3-alpha,5-alpha-Pregnanolone ######## Pregnan-20-one, 3-hydroxy-, (3-alpha,5-alpha)- 5alpha-孕甾-3alpha-醇-20-酮 |
| MDL Number | MFCD00003677 |
| Beilstein Registry Number | 3211363 |
| PubChem Substance ID | 92786 |
| Merck Number | 13,272 |
| Chemical Name Translation | 5α-孕甾-3α-醇-20-酮 |
| Wiswesser Line Notation | L E5 B666TJ A1 E1 FV1 OQ |
| LabNetwork Molecule ID | LN01272526 |
| InChI | InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-,21+/m0/s1 |
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分类
- {SNA} Bioactive Small Molecule Alphabetical Index, GABA and Glycine Receptor Modulators, GABAergics, Ion Channels, Ligand-Gated Ion Channels, Neuroscience, Neurotransmission, Neurotransmitters, Others, PI-PY, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
- {SNA} Bioactive
- {SNA} Bioactive Small Molecules,
- Neurochemicals
- Pharmaceuticals
- Intermediates & Fine Chemicals
- {SNA} GABA and Glycine Receptor Modulators, GABAergics, Ion Channels, Ligand-Gated Ion Channels, Neuroscience, Neurotransmission, Neurotransmitters, Others, PI-PY, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
产品应用
- (3?)-Allopregnanolone acts as a GABAA receptor positive allosteric modulator. (3?)-Allopregnanolone is a metabolite of Progesterone (P755900). (3?)-Allopregnanolone is a neuroactive steroid present in
相关文献及参考
- Puja, G. et al.: Neuron, 4, 759 (1990); Belelli, D. et ael. Neurosteroid, 6, 565 (2006); Viapiano, M. et al.: Neurochem. Res., 23, 155 (1998);
安全信息
- S22 Do not breathe dust 不要吸入粉尘；
- S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 15 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : 7 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 20 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
其他信息
- Sigma Aldrich:516-54-1(sigmaaldrich)
- MOL 文件:516-54-1.mol
- F:10
