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3'''-ACETYL-DIGOXIN,(3-BETA-O-(3'''-ACETYL)-TRI-BETA-D-DIGITOXOSID,5-BETA-H,12-BETA-OH)

Compound with spectra: 1 NMR

3'''-ACETYL-DIGOXIN,(3-BETA-O-(3'''-ACETYL)-TRI-BETA-D-DIGITOXOSID,5-BETA-H,12-BETA-OH)
SpectraBase Compound ID 4NVnjGc1XmK
InChI InChI=1S/C43H66O15/c1-20-38(49)32(55-23(4)44)18-37(52-20)58-40-22(3)54-36(17-31(40)46)57-39-21(2)53-35(16-30(39)45)56-26-9-11-41(5)25(14-26)7-8-28-29(41)15-33(47)42(6)27(10-12-43(28,42)50)24-13-34(48)51-19-24/h13,20-22,25-33,35-40,45-47,49-50H,7-12,14-19H2,1-6H3/t20-,21-,22-,25-,26+,27-,28-,29+,30+,31+,32+,33-,35+,36+,37+,38-,39-,40-,41+,42+,43+/m1/s1
InChIKey HWKJSYYYURVNQU-DXJNJSHLSA-N
Mol Weight 823.0 g/mol
Molecular Formula C43H66O15
Exact Mass 822.440171 g/mol
Enantiomer InChIKey HWKJSYYYURVNQU-GRCOQIORSA-N

View Spectrum of 3'''-ACETYL-DIGOXIN,(3-BETA-O-(3'''-ACETYL)-TRI-BETA-D-DIGITOXOSID,5-BETA-H,12-BETA-OH)

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:DMSO
Title Journal or Book Year
Carbon- 13 n.m.r. spectra of cardenolide glycosides. Configuration of the 11,12-epoxide in cerbertin Journal of the Chemical Society, Perkin Transactions 1 1981
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