(3S,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-7-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyl diacetate
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Grundinformationen
- CAS
13209-60-4- Standard-SMILES
CC(=O)O[C@H]1CC[C@@]2(C)C(=CC(=O)[C@H]3[C@@H]4CC[C@H](OC(C)=O)[C@@]4(C)CC[C@@H]32)C1- InChIKey
UCLVTARKINLGLA-GSLJADNHSA-N- Summenformel
- C23H32O5
- Durchschnittliche Molmasse
- 388,5 g/mol
Namen und Bezeichner
- Bevorzugter Name
- (3S,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-7-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyl diacetate
- IUPAC
- [(3S,8R,9S,10R,13S,14S,17S)-17-acetyloxy-10,13-dimethyl-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Namen und Synonyme
13209-60-4(3S,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-7-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyl diacetateSCHEMBL782338UCLVTARKINLGLA-GSLJADNHSA-N7-(acetyloxy)-9a,11a-dimethyl-4-oxo-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate3beta,17beta diacetoxyandrost-5-en-7-one3beta,17beta-diacetoxyandrost-5-en-7-one3beta,17beta-diacetoxy-androst-5-en-7-one7-oxo-5-androstene-3beta,17beta-diol diacetate
Datenbank-Bezeichner
- CAS
13209-60-4- PubChem CID
- 9886600
- Nikkaji
- J1.235.616A
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 3,4
- Polarare Oberfläche (TPSA)
- 69,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 739
Zugehörige Reaktionen
11
Notizen zur Verbindung
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