Pregnan-20-one,3,6-dihydroxy-, (3a,5b,6a)-

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Names

[ CAS No. ]:
570-78-5

[ Name ]:
Pregnan-20-one,3,6-dihydroxy-, (3a,5b,6a)-

[Synonym ]:
5beta-Pregnan-20-one,3alpha,6alpha-dihydroxy
pregnan-3,6-diol-20-one
3ALPHA,6ALPHA-Dihydroxy-5B-pregnan-20-one

Chemical & Physical Properties

[ Density]:
1.117g/cm3

[ Boiling Point ]:
469.7ºC at 760mmHg

[ Molecular Formula ]:
C21H34O3

[ Molecular Weight ]:
334.49300

[ Flash Point ]:
252ºC

[ Exact Mass ]:
334.25100

[ PSA ]:
57.53000

[ LogP ]:
3.56600

[ Index of Refraction ]:
1.541

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TU4380000
CHEMICAL NAME :
5-beta-Pregnan-20-one, 3-alpha,6-alpha-dihydroxy-
CAS REGISTRY NUMBER :
570-78-5
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H34-O3
MOLECULAR WEIGHT :
334.55
WISWESSER LINE NOTATION :
L E5 B666TJ A1 E1 FV1 LQ OQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
40 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

Precursor & DownStream

Precursor

DownStream

  • (3R,5R,6S,8R,9S,10R,13S,14S)-3,6-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
  • Methandriol

Related Compounds

  • Pregnan-20-one,3,17-dihydroxy-, (3a,5b)-
  • Cholan-24-aMide, 3,6-dihydroxy-, (3a,5b,6a)-
  • Pregnan-20-one,3,12-bis(acetyloxy)-, (3a,5b,12a)- (9CI)
  • Pregnan-20-one,3,11,17,21-tetrahydroxy-, (3a,5b,11b)-
  • Pregnan-20-one,3,21-bis(acetyloxy)-11-hydroxy-, (3a,5b,11b)- (9CI)
  • Pregnan-20-one,3-hydroxy-, cyclic 1,2-ethanediyl acetal, (3a,5b)- (9CI)
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 5-chloro-2-methoxy-N-(2-(2-oxo-2-(propylamino)ethyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 5-(5-Pyrimidinyl)indoline