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Substance Name: Strophanthidol-D-glucose
RN: 16479-53-1
InChIKey: JWQQCHZKTBEIQC-OXDHUBJPSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C29-H44-O11

Molecular Weight

  • 568.656
 
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Names and Synonyms

Results Name

  • Strophanthidol-D-glucose

Synonyms

  • 3-beta-((Glucopyranosyl)oxy)-5,14,19-trihydroxy-5-beta-card-20(22)-enolide
  • 4-18-00-03095 (Beilstein Handbook Reference)
  • BRN 0071908
  • Strophanthidol-D-glucose

Systematic Name

  • 5-beta-Card-20(22)-enolide, 3-beta-((D-glucopyranosyl)oxy)-5,14,19-trihydroxy-

Registry Numbers

CAS Registry Number

  • 16479-53-1

System Generated Number

  • 0016479531

Structure Descriptors

InChI

1S/C29H44O11/c1-26-6-3-18-19(29(26,37)9-5-17(26)15-10-21(32)38-13-15)4-8-28(36)11-16(2-7-27(18,28)14-31)39-25-24(35)23(34)22(33)20(12-30)40-25/h10,16-20,22-25,30-31,33-37H,2-9,11-14H2,1H3/t16-,17+,18?,19?,20?,22+,23?,24?,25+,26+,27-,28-,29-/m0/s1

InChIKey

JWQQCHZKTBEIQC-OXDHUBJPSA-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](O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C1)O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 100ug/kg (0.1mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 194, 1963.