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Substance Name: 5-beta-Card-20(22)-enolide, 3-beta-((3,4-O-benzylidene-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxy-
RN: 40279-64-9
InChIKey: HTIPRFQCVQFOMU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H48-O9

Molecular Weight

  • 624.7662
 
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Names and Synonyms

Synonyms

  • Benzaldehydhelveticosol
  • Benzaldehydhelveticosol [German]

Systematic Name

  • 5-beta-Card-20(22)-enolide, 3-beta-((3,4-O-benzylidene-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxy-

Registry Numbers

CAS Registry Number

  • 40279-64-9

System Generated Number

  • 0040279649

Structure Descriptors

InChI

1S/C36H48O9/c1-21-31-28(44-32(45-31)22-6-4-3-5-7-22)17-30(42-21)43-24-8-13-34(20-37)26-9-12-33(2)25(23-16-29(38)41-19-23)11-15-36(33,40)27(26)10-14-35(34,39)18-24/h3-7,16,21,24-28,30-32,37,39-40H,8-15,17-20H2,1-2H3

InChIKey

HTIPRFQCVQFOMU-UHFFFAOYSA-N

Smiles

CC1C2C(CC(O1)OC3CCC4(C5CCC6(C(CCC6(C5CCC4(C3)O)O)C7=CC(=O)OC7)C)CO)OC(O2)c8ccccc8

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 2075ug/kg (2.075mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 1854, 1972.