(6R,8R,9S,10R,13S,14S,17R)-17-acetyl-6,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Grundinformationen
- CAS
604-03-5- Standard-SMILES
CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C- InChIKey
BDQPONLPDKZVNG-SJIZYOMUSA-N- Summenformel
- C21H30O4
- Durchschnittliche Molmasse
- 346,5 g/mol
- Monoisotopische Masse
- 346,21440943
Namen und Bezeichner
- Bevorzugter Name
- (6R,8R,9S,10R,13S,14S,17R)-17-acetyl-6,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
- IUPAC
- (6R,8R,9S,10R,13S,14S,17R)-17-acetyl-6,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
- Englischer Name
- 6β,17α-Dihydroxyprogesterone
- Summenformel
- C21H30O4
- Molmasse
- 346.46
Namen und Synonyme
604-03-56beta,17alpha-Dihydroxyprogesterone6b,17a-Dihydroxyprogesterone(6R,8R,9S,10R,13S,14S,17R)-17-acetyl-6,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-oneNSC9729Pregn-4-ene-3,20-dione, 6,17-dihydroxy-, (6beta)-; Pregn-4-ene-3,20-dione, 6beta,17-dihydroxy- (8CI); (6beta)-6,17-Dihydroxypregn-4-ene-3,20-dione; 6beta,17alpha-Dihydroxyprogesterone; NSC 9729SCHEMBL13517611NSC-97296.beta.,17.alpha.-DihydroxyprogesteronePregn-4-ene-3, 6.beta.,17-dihydroxy-Pregn-4-ene-3, 6,17-dihydroxy-, (6.beta.)-6β,17-Dihydroxyprogesterone
Weitere Namen anzeigen
6β,17α-Dihydroxyprogesterone"6β,17a-Dihydroxyprogesterone"6β,17-Dihydroxypregn-4-ene-3,20-dione
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,9
- Polarare Oberfläche (TPSA)
- 74,6 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 667
Physikochemische Eigenschaften
- Schmelzpunkt
- 216 °C · >216°C (dec.)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Off-White to Pale Yellow
Chemie und Industrie
Anwendungen
Verwenden6β,17α-Dihydroxyprogesterone is a derivative of Progesterone (P755900) which is an endogenous steroid hormone involved in the menstrual cycle, pregnancy, and embryogenesis of humans and other species.
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