HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3beta-Acetoxy-5alpha-pregnan-20-one
-Acetate · -Pregnan-3β-ol-20-one3βAllogenein acetate · Allopregnanolone acetate · EPIALLOPREGNANOLONE ACETATE · 5α-PREGNAN-3β-OL-20-ONE ACETATE · Allopregnan-3β-ol-20-one acetate · 5A-pregnan-3B-ol-20-one 3B-acetate · Allopregnan-3.β.-ol-20-one acetate
Identifikatoren & physikalische Daten
| CAS No. | 906-83-2 |
|---|---|
| Summenformel | C23H36O3 |
| Durchschnittliche Molmasse | 360,5 g/mol |
| SMILES | CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H](C(C)=O)CC[C@@H]32)C1 |
| InChIKey | GFHOQCXDABGYAL-POBGKJHXSA-N |
| PubChem CID | 227113 |
| ChEBI | CHEBI:79918 |
| EC No. | 149-048-5 |
Chemische & physikalische Eigenschaften
| XLogP | 5,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 43,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 26 |
| Formalladung | 0 |
| Komplexität | 598 |
| Schmelzpunkt | 143 °C |
| Siedepunkt | 443.7±18.0 °C(Predicted) |
| Dichte | 1.07±0.1 g/cm3(Predicted) |
Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | 3 |
|---|
Anwendungen & Verwendung
Verwenden
5α-Pregnan-3β-ol-20-one 3β-Acetate is a derivative of Pregnenolone (P712200); a steroid hormone involved in the steroidogenesis of progesterone, mineralocorticoids, glucocorticoids, androgens, and estrogens. As such it is a prohormone. Pregnenolone is a GABAA antagonist and increases neurogenesis in the hippocampus. It is a modulator of cytochrome P 450-3A.