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Substance Name: 5-beta-Card-20(22)-enolide, 3-beta-((2,6-dideoxy-3,4-O-(p-methoxybenzylidene)-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxy-
RN: 40279-65-0
InChIKey: AXNUWHJUULNIRA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C37-H50-O10

Molecular Weight

  • 654.792
 
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Names and Synonyms

Synonyms

  • Anisaldehydhelveticosol
  • Anisaldehydhelveticosol [German]

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 40279-65-0

System Generated Number

  • 0040279650

Structure Descriptors

InChI

1S/C37H50O10/c1-21-32-29(46-33(47-32)22-4-6-24(42-3)7-5-22)17-31(44-21)45-25-8-13-35(20-38)27-9-12-34(2)26(23-16-30(39)43-19-23)11-15-37(34,41)28(27)10-14-36(35,40)18-25/h4-7,16,21,25-29,31-33,38,40-41H,8-15,17-20H2,1-3H3

InChIKey

AXNUWHJUULNIRA-UHFFFAOYSA-N

Smiles

CC1C2C(CC(O1)OC3CCC4(C5CCC6(C(CCC6(C5CCC4(C3)O)O)C7=CC(=O)OC7)C)CO)OC(O2)c8ccc(cc8)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 1828ug/kg (1.828mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 1854, 1972.