3alpha,11alpha-Dihydroxy-5beta-pregnan-20-one

CAS 600-52-2 MFCD N/A

化学结构图

600-52-2
SMILES: CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3C(O)CC12C

化学属性

Mol. Weight334.55
Mol. FormulaC21H34O3

别名和识别编码

Wiswesser Line NotationL E5 B666TJ A1 CQ E1 FV1 OQ
Chemical Name5-beta-Pregnan-20-one, 3-alpha,11-alpha-dihydroxy-
Synonym 3-alpha,11-alpha-Dihydroxy-5-beta-pregnan-20-one
CAS Number600-52-2
InChIKeyNFVCQZNBRFPYOP-WDDOJFKXSA-N
PubChem Substance ID101787
InChIInChI=1S/C21H34O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-19,23-24H,4-11H2,1-3H3/t13-,14-,15+,16-,17+,18-,19-,20+,21-/m1/s1
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安全信息

RTECSTU4381000
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

系列性分类


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