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Substance Name: 5-beta-Card-20(22)-enolide, 3-beta,12-beta,14-trihydroxy-, 3,12-diformate
RN: 1256-24-2
InChIKey: UCVINUPNPDPTFO-KDLVOSJUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H34-O7

Molecular Weight

  • 446.537
 
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Names and Synonyms

Synonyms

  • 3-12-Formyl-digoxigenin
  • 3-beta,12-beta,14-Trihydroxy-5-beta-card-20(22)-enolide 3,12-diformate
  • Card-20(22)-enolide, 3,12-bis(formyloxy)-14-hydroxy-, (3-beta,5-beta,12-beta)-

Systematic Name

  • 5-beta-Card-20(22)-enolide, 3-beta,12-beta,14-trihydroxy-, 3,12-diformate

Registry Numbers

CAS Registry Number

  • 1256-24-2

System Generated Number

  • 0001256242

Structure Descriptors

InChI

1S/C25H34O7/c1-23-7-5-17(31-13-26)10-16(23)3-4-19-20(23)11-21(32-14-27)24(2)18(6-8-25(19,24)29)15-9-22(28)30-12-15/h9,13-14,16-21,29H,3-8,10-12H2,1-2H3/t16-,17+,18-,19?,20?,21-,23+,24+,25+/m1/s1

InChIKey

UCVINUPNPDPTFO-KDLVOSJUSA-N

Smiles

C[C@]12[C@@]([C@@H]3[C@@H]([C@@]4([C@@H](C[C@@H](OC=O)CC4)CC3)C)C[C@H]2OC=O)(CC[C@@H]1C1=CC(=O)OC1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo intravenous 4750ug/kg (4.75mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: OTHER CHANGES
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.
mouse LD50 oral 33680ug/kg (33.68mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: OTHER CHANGES
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.
mouse LD50 subcutaneous 19420ug/kg (19.42mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: OTHER CHANGES
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.