16alpha-17alpha-Isopropylidenedioxy-4-pregnen-21-ol-3,20-dione 21-acetate
Grundinformationen
- CAS
5095-00-1- Standard-SMILES
CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]12C- InChIKey
UJUXTIHDKDJBLG-IMNLCBETSA-N- Summenformel
- C26H36O6
- Durchschnittliche Molmasse
- 444,6 g/mol
- Monoisotopische Masse
- 444,25118886
Namen und Bezeichner
- Bevorzugter Name
- 16alpha-17alpha-Isopropylidenedioxy-4-pregnen-21-ol-3,20-dione 21-acetate
- IUPAC
- [2-oxo-2-[(1R,2S,4R,8S,9S,12S,13R)-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl]ethyl] acetate
Namen und Synonyme
70K4I0I12Y16alpha-17alpha-Isopropylidenedioxy-4-pregnen-21-ol-3,20-dione 21-acetate5095-00-1UNII-70K4I0I12YCorticosterone, 11-deoxy-16alpha,17-dihydroxy-, 21-acetate, cyclic 16,17-acetal with acetonePregn-4-ene-3,20-dione, 21-(acetyloxy)-16,17-((1-methylethylidene)bis(oxy))-, (16alpha)-Pregn-4-ene-3,20-dione, 16alpha,17,21-trihydroxy-, cyclic 16,17-acetal with acetone, 21-acetatePregn-4-ene-3,20-dione, 16alpha,17,21-trihydroxy-, cyclic 16,17-acetal with acetone, acetateQ2726587416.ALPHA.-17.ALPHA.-ISOPROPYLIDENEDIOXY-4-PREGNEN-21-OL-3,20-DIONE 21-ACETATECORTICOSTERONE, 11-DEOXY-16.ALPHA.,17-DIHYDROXY-, 21-ACETATE, CYCLIC 16,17-ACETAL WITH ACETONEPREGN-4-ENE-3,20-DIONE, 16.ALPHA.,17,21-TRIHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE, 21-ACETATE
Weitere Namen anzeigen
PREGN-4-ENE-3,20-DIONE, 16.ALPHA.,17,21-TRIHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE, ACETATEPREGN-4-ENE-3,20-DIONE, 21-(ACETYLOXY)-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (16.ALPHA.)-
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,4
- Polarare Oberfläche (TPSA)
- 78,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 32
- Formalladung
- 0
- Komplexität
- 904
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