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Substance Name: Xysmalogenin
RN: 508-92-9
InChIKey: ZICGJBPBLVXOBM-MITUEXOSSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C23-H32-O4

Molecular Weight

  • 372.5018
 
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Names and Synonyms

Results Name

  • Xysmalogenin

Synonyms

  • (3-beta)-3,14-Dihydroxycarda-5,20(22)-dienolide
  • 4-18-00-01602 (Beilstein Handbook Reference)
  • 5-Dehydrouzarigenin
  • BRN 0051836
  • Xysmalogenin

Systematic Names

  • Carda-5,20(22)-dienolide, 3,14-dihydroxy-, (3-beta)- (9CI)
  • Carda-5,20(22)-dienolide, 3-beta,14-dihydroxy-

Registry Numbers

CAS Registry Number

  • 508-92-9

Other Registry Number

  • 11032-22-7

System Generated Number

  • 0000508929

Structure Descriptors

InChI

1S/C23H32O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h3,11,16-19,24,26H,4-10,12-13H2,1-2H3/t16-,17+,18-,19+,21-,22+,23-/m0/s1

InChIKey

ZICGJBPBLVXOBM-MITUEXOSSA-N

Smiles

C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 1280ug/kg (1.28mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 194, 1963.