3'H-Cyclopropa(1,2)pregna-1,4-diene-3,6,20-trione, 1beta,2beta-dihydro-17-hydroxy-, acetate
Grundinformationen
- CAS
17184-05-3- Standard-SMILES
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3CC(=O)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@@]21C- InChIKey
WIRUTYUSQYFQAC-FDTZYFLXSA-N- Summenformel
- C24H30O5
- Durchschnittliche Molmasse
- 398,5 g/mol
- Monoisotopische Masse
- 398,20932405
Namen und Bezeichner
- Bevorzugter Name
- 3'H-Cyclopropa(1,2)pregna-1,4-diene-3,6,20-trione, 1beta,2beta-dihydro-17-hydroxy-, acetate
- IUPAC
- [(1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-2,16-dimethyl-6,9-dioxo-15-pentacyclo[9.7.0.02,8.03,5.012,16]octadec-7-enyl] acetate
- Englischer Name
- 6-Keto Cyproterone Acetate
- Summenformel
- C24H30O5
- Molmasse
- 398.49
Namen und Synonyme
3'H-Cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione, 1beta,2beta-dihydro-17-hydroxy-, acetate3'H-Cyclopropa(1,2)pregna-1,4-diene-3,6,20-trione, 1beta,2beta-dihydro-17-hydroxy-, acetateRefChem:48474117184-05-36-Keto Cyproterone AcetateCyproterone Acetate EP Impurity E[(1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-2,16-dimethyl-6,9-dioxo-15-pentacyclo[9.7.0.02,8.03,5.012,16]octadec-7-enyl] acetate(2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-Acetyl-3b,5a-dimethyl-2,10-dioxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b,9,10-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-yl acetate3'H-Cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione, 1ss,2ss-dihydro-17-hydroxy-, acetate (8CI); 1a,2a-Methylene-3,6,20-trioxopregna-4-en-17a-yl Acetate; 3,6,20-Trioxo-1ss,2ss-dihydro-3'H-cyclopropa[1,2]pregna-1,4-dien-17-yl AcetatePT2TTV9KZTDTXSID50857905Cyproterone acetate EP Impurity E
Weitere Namen anzeigen
Cyproterone Acetate Impurity 5（Cyproterone Acetate EP Impurity E）1β,2β-Dihydro-17-hydroxy-3'H-cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione Acetate3′H-Cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione, 1β,2β-dihydro-17-hydroxy-, acetate3'H-Cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione, 1β,2β-dihydro-17-hydroxy-, acetate (8CI)(2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-Acetyl-3b,5a-dimethyl-2,10-dioxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b,9,10-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-yl acetate (Cyproterone Acetate Impurity)
1beta,2beta-Dihydro-17-hydroxy-3'H-cyclopropa[1,2]pregna-1,4-diene-3,6,20-trione AcetateCYPROTERONE ACETATE IMPURITY E [EP IMPURITY]3,6,20-trioxo-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-1,4-dien-17-yl acetate(1R,3aS,3bR,7aR,8aS,8bS,8cS,10aS)-1-Acetyl-8b,10a-dimethyl-5,7-dioxo-1,2,3,3a,3b,4,5,7,7a,8,8a,8b,8c,9,10,10a-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl acetate(2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-Acetyl-3b,5a-dimethyl-2,10-dioxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b,9,10-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-ylacetate3,6,20-trioxo-1|A,2|A-dihydro-3 inverted exclamation markaH-cyclopropa[1,2]pregna-1,4-dien-17-yl acetate3,6,20-trioxo-1|A,2|A-dihydro-3 inverted exclamation markaH-cyclopropa[1,2]pregna-1,4-dien-17-yl acetate;(2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-acetyl-3b,5a-dimethyl-2,10-dioxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b,9,10-hexadecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-yl acetate
Datenbank-Bezeichner
- CAS
17184-05-3- PubChem CID
- 71749674
- DTXSID
DTXSID50857905- UNII
- PT2TTV9KZT
- EC Number
- 690-916-2
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,6
- Polarare Oberfläche (TPSA)
- 77,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 29
- Formalladung
- 0
- Komplexität
- 886
Physikochemische Eigenschaften
- Schmelzpunkt
- 251 °C · >251°C (dec.)
- Siedepunkt
- 528 · 528.0±50.0 °C(Predicted)
- Dichte
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- storage temp.
- Refrigerator
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Pale Yellow
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesCarc. 2 (100%)
Sicherheitsdaten
- Alarmwort
- Achtung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H351
Chemie und Industrie
Anwendungen
Verwenden6-Keto Cyproterone Acetate (Cyproterone Acetate EP Impurity E) is an impurity of Cyproterone acetate (C989100), a new antiandrogenic steroid.
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