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Substance Name: Scilliglaucoside
RN: 510-58-7
UNII: 0AD04KS0VY
InChIKey: QDBIBEXZLJNVNH-TVVIPLERSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C30-H40-O10

Molecular Weight

  • 560.636
 
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Names and Synonyms

Results Name

  • Scilliglaucoside

Name of Substance

  • Scilliglaucoside

Synonyms

  • 4-18-00-02665 (Beilstein Handbook Reference)
  • 5-(beta-D-Glucopyranosyloxy)-14-hydroxy-19-oxo-bufa-3,20,22-trienolide (5-beta)-
  • BRN 0072230
  • Scillaren F
  • Scilliglaucosid
  • Scilliglaucosid [German]
  • Scilliglaucoside
  • Scilliglaucosidin + glucose
  • Scilliglaucosidin + glucose [German]
  • UNII-0AD04KS0VY

Systematic Name

  • Bufa-3,20,22-trienolide, 5-(beta-D-glucopyranosyloxy)-14-hydroxy-19-oxo-, (5-beta)-

Registry Numbers

CAS Registry Number

  • 510-58-7

FDA UNII

  • 0AD04KS0VY

System Generated Number

  • 0000510587

Structure Descriptors

InChI

1S/C30H40O10/c1-27-11-6-19-20(30(27,37)13-8-18(27)17-4-5-22(33)38-15-17)7-12-29(10-3-2-9-28(19,29)16-32)40-26-25(36)24(35)23(34)21(14-31)39-26/h3-5,10,15-16,18-21,23-26,31,34-37H,2,6-9,11-14H2,1H3/t18-,19+,20-,21-,23-,24+,25-,26+,27-,28+,29-,30+/m1/s1

InChIKey

QDBIBEXZLJNVNH-TVVIPLERSA-N

Smiles

C[C@]12CC[C@H]3[C@@H](CC[C@]4(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C=CCC[C@]34C=O)[C@@]1(O)CC[C@@H]2C6=COC(=O)C=C6

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 70ug/kg (0.07mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 194, 1963.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.530 (none)   EST
Water Solubility 3330 mg/L 20 EXP
Atmospheric OH Rate Constant 2.48E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.