HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
ergosterol-5,8-peroxide
Ergosterol peroxide · Peroxyergosterol · ergosterol oeroxide · ergosterol-5,8-peroxide · Ergosterol endoperoxide · Ergosterol 5α,8α-epidioxide · (22E)-5α,8α-Epidioxyergosta-6,22-diene-3β-ol · (22E)-5α,8α-Epidioxy-5α-ergosta-6,22-dien-3β-ol
Identifikatoren & physikalische Daten
| CAS No. | 2061-64-5 |
|---|---|
| Summenformel | C28H44O3 |
| Durchschnittliche Molmasse | 428,65 g/mol |
| SMILES | CC(C)C(C)/C=C/C(C)C1CCC2C1(C)CCC1C23C=CC2(CC(O)CCC12C)OO3 |
| PubChem CID | 5379713 |
Chemische & physikalische Eigenschaften
| Schmelzpunkt | 178 °C |
|---|---|
| Siedepunkt | 499.7±45.0 °C(Predicted) |
| Dichte | 1.08±0.1 g/cm3(Predicted) |
| Lagerbedingungen | Store at -20°C |
| Löslichkeit | Methanol: soluble |
| Aggregatzustand | Powder |
| pKa (Säurekonstante) | 14.97±0.70(Predicted) |
| Farbe | White to off-white |
| Kosmetik-Inhaltsstoffe Funktionen | BLEACHINGSKIN CONDITIONINGHUMECTANT |
| InChIKey | LXIJTUMNXIROPP-LJJIWTQONA-N |
| SMILES | [C@@]123OO[C@@]4(C[C@@H](O)CC[C@]4(C)[C@@]1([H])CC[C@]1(C)[C@@](CC[C@@]21[H])(O)[C@H](C)/C=C/[C@H](C)C(C)C)C=C3 |&1:0,3,5,9,11,15,17,20,23,27,r| |
Anwendungen & Verwendung
Verwenden
Network pharmacology and molecular docking study on inhibition of Mpro, primary protease of COVID-19, by Poria cocos and its active compounds.