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Substance Name: 5-beta-Bufa-20,22-dienolide, 3-beta-((6-deoxy-3-O-methylglucopyranosyl)oxy)-14,16-dihydroxy-19-oxo-, 16-acetate
RN: 100991-80-8
InChIKey: XBAVBFJNZQVZDW-UHFFFAOYSA-N

Molecular Formula

  • C33-H46-O11

Molecular Weight

  • 618.7154
 
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Names and Synonyms

Synonyms

  • Acetylbovosid D
  • Acetylbovosid D [German]
  • Acetylbovoside D

Systematic Name

  • 5-beta-Bufa-20,22-dienolide, 3-beta-((6-deoxy-3-O-methylglucopyranosyl)oxy)-14,16-dihydroxy-19-oxo-, 16-acetate

Registry Numbers

CAS Registry Number

  • 100991-80-8

System Generated Number

  • 0100991808

Structure Descriptors

InChI

1S/C33H46O11/c1-17-27(37)29(40-4)28(38)30(42-17)44-21-9-12-32(16-34)20(13-21)6-7-23-22(32)10-11-31(3)26(19-5-8-25(36)41-15-19)24(43-18(2)35)14-33(23,31)39/h5,8,15-17,20-24,26-30,37-39H,6-7,9-14H2,1-4H3

InChIKey

XBAVBFJNZQVZDW-UHFFFAOYSA-N

Smiles

CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5c6ccc(=O)oc6)OC(=O)C)O)C)C=O)O)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 120ug/kg (0.12mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 187, 1963.