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Substance Name: Strophanthidin-3-chloroacetate
RN: 52552-28-0
InChIKey: LFDSJZUWJKJWAH-CLEWGDABSA-N

Molecular Formula

  • C25-H33-Cl-O7

Molecular Weight

  • 480.982
 
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Names and Synonyms

Results Name

  • Strophanthidin-3-chloroacetate

Synonyms

  • (3-beta,5-beta)-3-((Chloroacetyl)oxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide
  • 4-18-00-03130 (Beilstein Handbook Reference)
  • BRN 0067332
  • Strophanthidin-3-chloroacetate

Systematic Name

  • Card-20(22)-enolide, 3-((chloroacetyl)oxy)-5,14-dihydroxy-19-oxo-, (3-beta,5-beta)-

Registry Numbers

CAS Registry Number

  • 52552-28-0

System Generated Number

  • 0052552280

Structure Descriptors

InChI

1S/C25H33ClO7/c1-22-6-3-18-19(25(22,31)9-5-17(22)15-10-20(28)32-13-15)4-8-24(30)11-16(33-21(29)12-26)2-7-23(18,24)14-27/h10,14,16-19,30-31H,2-9,11-13H2,1H3/t16-,17?,18?,19?,22+,23-,24-,25-/m0/s1

InChIKey

LFDSJZUWJKJWAH-CLEWGDABSA-N

Smiles

C1[C@@]2([C@@H]3[C@@H]([C@@]4([C@]([C@@H](C5=CC(=O)OC5)CC4)(C)CC3)O)CC[C@@]2(C[C@H](OC(CCl)=O)C1)O)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 1052ug/kg (1.052mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Journal of Pharmacology and Experimental Therapeutics. Vol. 82, Pg. 98, 1944.