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Substance Name: Bovogenin A
RN: 468-18-8
InChIKey: STSJQAAJJHGCMJ-XZOYFZSUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H32-O5

Molecular Weight

  • 400.5118
 
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Names and Synonyms

Results Name

  • Bovogenin A

Synonyms

  • 3-beta,14-Dihydroxy-19-oxo-5-alpha-bufa-20,22-dienolide
  • 4-18-00-02592 (Beilstein Handbook Reference)
  • Bovogenin A
  • BRN 0053724

Systematic Names

  • 5-alpha-Bufa-20,22-dienolide, 3-beta,14-dihydroxy-19-oxo-
  • Bufa-20,22-dienolide, 3,14-dihydroxy-19-oxo-, (3-beta,5-alpha)- (9CI)

Registry Numbers

CAS Registry Number

  • 468-18-8

System Generated Number

  • 0000468188

Structure Descriptors

InChI

1S/C24H32O5/c1-22-9-7-19-20(4-3-16-12-17(26)6-10-23(16,19)14-25)24(22,28)11-8-18(22)15-2-5-21(27)29-13-15/h2,5,13-14,16-20,26,28H,3-4,6-12H2,1H3/t16-,17-,18+,19-,20+,22+,23+,24-/m0/s1

InChIKey

STSJQAAJJHGCMJ-XZOYFZSUSA-N

Smiles

C1[C@@]2([C@@H]3[C@@H]([C@@]4([C@]([C@@H](c5ccc(=O)oc5)CC4)(C)CC3)O)CC[C@H]2C[C@H](O)C1)C=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 132ug/kg (0.132mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 3, Pg. 111, 1961.