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Substance Name: 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methylgalactopyranosyl)oxy)-14-hydroxy-11-oxo-
RN: 101418-20-6
InChIKey: OFHFAWOWNDPPEH-ACXZCSKNSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C30-H44-O9

Molecular Weight

  • 548.669
 
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Names and Synonyms

Synonyms

  • 4-18-00-02546 (Beilstein Handbook Reference)
  • BRN 0071919
  • Desaroside

Systematic Name

  • 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methylgalactopyranosyl)oxy)-14-hydroxy-11-oxo-

Registry Numbers

CAS Registry Number

  • 101418-20-6

System Generated Number

  • 0101418206

Structure Descriptors

InChI

1S/C30H44O9/c1-15-24(33)26(36-4)25(34)27(38-15)39-18-7-9-28(2)17(12-18)5-6-20-23(28)21(31)13-29(3)19(8-10-30(20,29)35)16-11-22(32)37-14-16/h11,15,17-20,23-27,33-35H,5-10,12-14H2,1-4H3/t15?,17-,18+,19-,20?,23?,24+,25?,26?,27+,28+,29-,30+/m1/s1

InChIKey

OFHFAWOWNDPPEH-ACXZCSKNSA-N

Smiles

C1[C@@H]2[C@@]3([C@@]([C@@H](C=4COC(C4)=O)CC3)(CC([C@@H]2[C@@]2([C@H](C[C@@H](O[C@H]3[C@@H]([C@H]([C@@H](O)[C@@H](O3)C)OC)O)CC2)C1)C)=O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 600ug/kg (0.6mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 190, 1963.