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565-99-1

565-99-1 structure
565-99-1 structure
  • Name: Pregnane-11,20-dione,3-hydroxy-, (3a,5b)-
  • Chemical Name: (3R,5R,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
  • CAS Number: 565-99-1
  • Molecular Formula: C21H32O3
  • Molecular Weight: 332.47700
  • Create Date: 2018-06-17 11:26:42
  • Modify Date: 2024-01-11 18:37:59

Name (3R,5R,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
Synonyms 11-Oxopregnanolone
3alpha-Hydroxy-11,20-pregnadien
3alpha-Hydroxy-5beta-pregnane-11,20-dione
Renanolone
11-Ketopregnanolone
Density 1.212g/cm3
Boiling Point 504ºC at 760mmHg
Molecular Formula C21H32O3
Molecular Weight 332.47700
Flash Point 272.7ºC
Exact Mass 332.23500
PSA 54.37000
LogP 3.77420
Index of Refraction 1.562

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TU4157900
CHEMICAL NAME :
5-beta-Pregnane-11,20-dione, 3-alpha-hydroxy-
CAS REGISTRY NUMBER :
565-99-1
LAST UPDATED :
199709
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H32-O3
MOLECULAR WEIGHT :
332.53
WISWESSER LINE NOTATION :
L E5 B666 CVTJ A1 E1 FV1 OQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
68 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
160 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,117,1968
Precursor  0

DownStream  1