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20(22)-DIHYDRO-DIGITOXIGENIN,(3-BETA-OH,5-BETA-H)
SpectraBase Compound ID LyPdgN3AJAF
InChI InChI=1S/C23H36O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h14-19,24,26H,3-13H2,1-2H3/t14?,15-,16+,17-,18+,19-,21+,22-,23+/m1/s1
InChIKey CIQHGVTXALCNSM-CELFAQOLSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWwby4JlWNT
Name 20(22)-DIHYDRO-DIGITOXIGENIN,(3-BETA-OH,5-BETA-H)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h14-19,24,26H,3-13H2,1-2H3/t14?,15-,16+,17-,18+,19-,21+,22-,23+/m1/s1
InChIKey CIQHGVTXALCNSM-CELFAQOLSA-N
Literature Reference Author H.T.A.CHEUNG,L.BROWN,J.BOUTAGY,R.THOMAS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1773(1981)
Literature Reference DOI 10.1039/p19810001773
Molecular Weight 376.536 g/mol
Solvent CDCl3
Source File Reference UNIW8508