5-beta-Card-20(22)-enolide, 3-beta,14-dihydroxy-,3-acetate

CAS 808-19-5 MFCD00808195

化学结构图

808-19-5
SMILES: CC(=O)O[C@@H]1CC[C@]2(C)[C@H](C1)CC[C@H]1[C@H]2CC[C@@]2(C)[C@@H](CC[C@]21O)C1COC(=O)C=1 |&1:4,7,9,13,14,17,19,22|

化学属性

Mol. FormulaC25H36O5
Mol. Weight416.61

别名和识别编码

Wiswesser Line NotationL E5 B666TJ A1 E1 IQ OOV1 F- DT5OV EHJ
Chemical Name3-beta-acetoxy-14-hydroxy-5-beta,14-beta-card-20(22)-enolide
Synonym Digitoxigenin-3-acetate Card-20(22)-enolide, 3-(acetyloxy)-14-hydroxy-, (3-beta,5-beta)- 3-O-Acetyldigitoxigenin Digitoxigenin acetate 3-Acetyldigitoxigenin Digitoxigenin-3-beta-acetate
CAS Number808-19-5
Beilstein Registry Number0097888
Chemicalbook IDCB1879548
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安全信息

RTECSFH4975070 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 645 ug/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: 18,1258,1975

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Parenteral
SPECIES OBSERVED        : Bird - pigeon
DOSE/DURATION           : 1870 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 8,18,1960

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 6120 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 18,311,1962

系列性分类

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