chloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate
Grundinformationen
- CAS
82034-20-6- Standard-SMILES
CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C- InChIKey
MRTXSPBAHVGOKO-HROMYWEYSA-N- Summenformel
- C24H33ClO7
- Durchschnittliche Molmasse
- 469 g/mol
Namen und Bezeichner
- Bevorzugter Name
- chloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate
- IUPAC
- chloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate
- Englischer Name
- loteprednol Impurity 7
- Summenformel
- C24H33ClO7
- Molmasse
- 468.97
Namen und Synonyme
82034-20-6Loteprednol Impurity 33SCHEMBL16857771,2-DihydroLoteprednolEtabonatechloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-((ethoxycarbonyl)oxy)-11-hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylateChloromethyl (8S,9S,10R,11S,13S,14S,17R)-17-((ethoxycarbonyl)oxy)-11-hydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate (Loteprednol impurity)loteprednol Impurity 7Loteprednol Impurity 35Loteprednol etabonate Impurity 5Loteprednol Etabonate Impurity 6Loteprednol Etabonate 1,2-Dihydro1,2-Dihydro Loteprednol Etabonate
Weitere Namen anzeigen
Androst-4-ene-17-carboxylic acid, 17-[(ethoxycarbonyl)oxy]-11-hydroxy-3-oxo-, chloromethyl ester, (11β,17α)-
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,6
- Polarare Oberfläche (TPSA)
- 99,1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 32
- Formalladung
- 0
- Komplexität
- 840
Physikochemische Eigenschaften
- Siedepunkt
- 597.4 · 597.4±50.0 °C(Predicted)
- Dichte
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 14.15 · 14.15±0.70(Predicted)
Chemie und Industrie
Anwendungen
Verwenden1,2-Dihydro Loteprednol Etabonate is derived from Cortienic Acid (Cortienic Acid), which is a synthetic steroid modeled based on hydrocortisone (H714615), a glucocorticoid produced by the zona fasciculata of the adrenal gland. Cortienic Acid is developed as a steroidal antiinflammatory agents.
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