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ACETYLDIGITOXIGENIN,(3-BETA-OAC,5-BETA-H)
SpectraBase Compound ID 8XUq8OUUVcU
InChI InChI=1S/C25H36O5/c1-15(26)30-18-6-9-23(2)17(13-18)4-5-21-20(23)7-10-24(3)19(8-11-25(21,24)28)16-12-22(27)29-14-16/h12,17-21,28H,4-11,13-14H2,1-3H3/t17-,18+,19-,20+,21-,23+,24-,25+/m1/s1
InChIKey WJOGTCZNZPHODB-WQFRYHCKSA-N
Mol Weight 416.6 g/mol
Molecular Formula C25H36O5
Exact Mass 416.256274 g/mol
Enantiomer InChIKey WJOGTCZNZPHODB-WJEZMIPNSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CHCl3:CH3OH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OD
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 300896
Solvent CDCl3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 300896
Solvent CDCl3
  • 3-BETA-ACETOXY-DIGITOXIGENIN
  • 3-ACETYL-DIGITOXIGENIN
  • DIGITOXIGENIN-ACETAT=3-BETA-O-ACETYL-14-HYDROXY-5-BETA-CARD-20(22)-ENOLID
  • 17-BETA-(2',5'-DIHYDRO-5'-OXO-3'-FURYL)-5-BETA,14-BETA-ANDROSTAN-3-BETA,14-DIOL-3-ACETATE
  • Digitoxigenin 3-acetate
Title Journal or Book Year
13C NMR spectra of 5β,14β-hydroxysteroids Magnetic Resonance in Chemistry 1985
7β,8β-Epoxycardenolide glycosides of Asclepias eriocarpa J. Chem. Soc., Perkin Trans. 1 1980
18,20-Oxido-20,22-dihydroneriifolin, an unusual oxygenated cardanolide The Journal of Organic Chemistry 1979
13C n.m.r. spectra of steroids —a survey and commentary Organic Magnetic Resonance 1977
Carbon-13 nuclear magnetic resonance spectra of cardenolides Tetrahedron Letters 1973

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