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Substance Name: 20,22-Dihydrodigitoxigenin
RN: 4427-85-4
InChIKey: CIQHGVTXALCNSM-ROIXOECXSA-N

Note

  • Cardiotonic steroid.

Molecular Formula

  • C23-H36-O4

Molecular Weight

  • 376.533
 
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Names and Synonyms

Name of Substance

  • 20,22-Dihydrodigitoxigenin

Synonyms

  • 20,22-Dihydrodigitoxigenin
  • Dihydrodigitoxigenin
  • EINECS 224-612-4

Systematic Names

  • (5beta)-3beta,14-Dihydroxycardanolide
  • 5-beta-Cardanolide, 3-beta,14-dihydroxy- (6CI,7CI,8CI)
  • Cardanolide, 3,14-dihydroxy-, (3-beta,5-beta)-

Registry Numbers

CAS Registry Number

  • 4427-85-4

System Generated Number

  • 0004427854

Structure Descriptors

InChI

1S/C23H36O4/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/h14-19,24,26H,3-13H2,1-2H3/t14-,15+,16-,17+,18-,19+,21-,22+,23-/m0/s1

InChIKey

CIQHGVTXALCNSM-ROIXOECXSA-N

Smiles

C1[C@@]2(O)[C@@]([C@H]([C@H]3CC(=O)OC3)C1)(CC[C@@H]1[C@@]3(CC[C@@H](C[C@H]3CC[C@@H]21)O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous > 13mg/kg (13mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 18, Pg. 311, 1962.
guinea pig LDLo intravenous > 25mg/kg (25mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 18, Pg. 311, 1962.