Strophanthidin, 3-bromoacetate

Names

[ CAS No. ]:
4956-18-7

[ Name ]:
Strophanthidin, 3-bromoacetate

[Synonym ]:
strophanthidin 3-bromoacetate
Strophanthidin bromoacetate

Chemical & Physical Properties

[ Density]:
1.49g/cm3

[ Boiling Point ]:
653.8ºC at 760 mmHg

[ Molecular Formula ]:
C25H33BrO7

[ Molecular Weight ]:
525.42900

[ Flash Point ]:
349.2ºC

[ Exact Mass ]:
524.14100

[ PSA ]:
110.13000

[ LogP ]:
2.84400

[ Index of Refraction ]:
1.609

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FH5430000
CHEMICAL NAME :
5-beta-Card-20(22)enolide, 3-beta,5,14-trihydroxy-19-oxo-, 3-(bromoacetate)
CAS REGISTRY NUMBER :
4956-18-7
BEILSTEIN REFERENCE NO. :
0067333
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C25-H33-Br-O7
MOLECULAR WEIGHT :
525.49

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
8812 ug/kg
TOXIC EFFECTS :
Nutritional and Gross Metabolic - changes in phosphorus
REFERENCE :
BRCAB7 Basic Research in Cardiology. (Dr. Dietrich Steinkopff Verlag, Postfach 111008, D-6100 Darmstadt 11, Fed. Rep. Ger.) V.68- 1973- Volume(issue)/page/year: 76,62,1981

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Bromoacetyl chloride
  • Card-20(22)-enolide,3,5,14-trihydroxy-19-oxo-, (3b,5b)-
  • Bromoacetyl bromide

DownStream

Related Compounds

  • [(3S,5S,10S,13R,14S)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloroacetate
  • Strophanthidin 3-[(dipropylamino)acetate]
  • [(3S,5S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] butanoate
  • Strophanthidin 3-[(diethylamino)acetate]
  • Strophanthidin 3-[(dimethylamino)acetate]
  • [(3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate