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Substance Name: Bovosidol A
RN: 468-13-3
InChIKey: OXBRMYXRHPWEIC-MXGRDHLTSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C31-H46-O9

Molecular Weight

  • 562.6954
 
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Names and Synonyms

Results Name

  • Bovosidol A

Synonyms

  • 4-18-00-02558 (Beilstein Handbook Reference)
  • Bovosidol A
  • BRN 0071268

Systematic Name

  • Bufa-20,22-dienolide, 3-(6-deoxy-3-O-methyl-D-glucopyranosyl)oxy-14,19-dihydroxy-

Registry Numbers

CAS Registry Number

  • 468-13-3

System Generated Number

  • 0000468133

Structure Descriptors

InChI

1S/C31H46O9/c1-17-25(34)27(37-3)26(35)28(39-17)40-20-8-12-30(16-32)19(14-20)5-6-23-22(30)9-11-29(2)21(10-13-31(23,29)36)18-4-7-24(33)38-15-18/h4,7,15,17,19-23,25-28,32,34-36H,5-6,8-14,16H2,1-3H3/t17?,19-,20+,21-,22?,23?,25-,26?,27?,28+,29-,30-,31+/m1/s1

InChIKey

OXBRMYXRHPWEIC-MXGRDHLTSA-N

Smiles

COC1[C@H](O)C(C)O[C@@H](O[C@H]2CC[C@@]3(CO)[C@H](CCC4C3CC[C@]5(C)[C@H](CC[C@]45O)C6=COC(=O)C=C6)C2)C1O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 120ug/kg (0.12mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 190, 1963.