Grundinformationen
- Standard-SMILES
C/C=C1/CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(C)=O)CC[C@]4(C)C3=CC[C@]12C- InChIKey
TYZQYJJHKVTJMQ-YVPOXDCLSA-N- Summenformel
- C23H34O2
- Durchschnittliche Molmasse
- 342,5 g/mol
Namen und Bezeichner
- Bevorzugter Name
- (3R,5R,8S,10S,13S,14S,Z)-17-Ethylidene-10,13-dimethyl-2,3,4,5,6,7,8,10,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[A]phenanthren-3-YL acetate
- IUPAC
- [(3R,5R,8S,10S,13S,14S,17Z)-17-ethylidene-10,13-dimethyl-1,2,3,4,5,6,7,8,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Namen und Synonyme
1093397-69-3(3R,5R,8S,10S,13S,14S,Z)-17-ETHYLIDENE-10,13-DIMETHYL-2,3,4,5,6,7,8,10,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-YL ACETATESCHEMBL330506TYZQYJJHKVTJMQ-YVPOXDCLSA-N(Z)-3alpha-Acetoxy-5beta-pregna-9(11),17(20)-diene(Z)-3alpha-Acetoxy-5beta-pregna-9 (11),17 (20)-diene(Z)-3alpha-Acetoxy-5beta-pregna-9(11), 17(20)-diene(3R,5R,8S,10S,13S,14S,Z)-17-ETHYLIDENE-10,13-DIMETHYL-2,3,4,5,6,7,8,10,12,13,14,15,16,17-TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-YLACETATE
Datenbank-Bezeichner
- PubChem CID
- 25145012
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,4
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 630
Zugehörige Reaktionen
15
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