Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetylcinobufagin
RN: 4026-97-5
InChIKey: DXSNTGMCQRLLQF-GLFSEUORSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C28-H36-O7

Molecular Weight

  • 484.585
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Acetylcinobufagin

Synonyms

  • 3-beta,16-beta-Dihydroxy-14,15-beta-epoxy-5-beta-bufa-20,22-dienolide 3,16-diacetate
  • Acetylcinobufagin
  • Bufa-20,22-dienolide, 3,16-dihydroxy-14,15-epoxy-, 3,16-diacetate
  • Cinobufagin acetate (6CI)
  • Cinobufagin, 3-acetyl-

Systematic Name

  • 5-beta-Bufa-20,22-dienolide, 14,15-beta-epoxy-3-beta,16-beta-dihydroxy-, 3,16-diacetate

Registry Numbers

CAS Registry Number

  • 4026-97-5

System Generated Number

  • 0004026975

Structure Descriptors

InChI

1S/C28H36O7/c1-15(29)33-19-9-11-26(3)18(13-19)6-7-21-20(26)10-12-27(4)23(17-5-8-22(31)32-14-17)24(34-16(2)30)25-28(21,27)35-25/h5,8,14,18-21,23-25H,6-7,9-13H2,1-4H3/t18-,19+,20?,21?,23+,24-,25-,26+,27-,28-/m1/s1

InChIKey

DXSNTGMCQRLLQF-GLFSEUORSA-N

Smiles

O1[C@]23[C@H]1[C@H](OC(C)=O)[C@@H]([C@@]2(CC[C@@H]1[C@@H]3CC[C@H]2[C@@]1(CC[C@@H](C2)OC(C)=O)C)C)c1ccc(=O)oc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 590ug/kg (0.59mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 187, 1963.