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Digitoxigenin
SpectraBase Compound ID FEoSdhHhS4j
InChI InChI=1S/C23H34O4/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/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23+/m1/s1
InChIKey XZTUSOXSLKTKJQ-CESUGQOBSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7t4rINPend
Name DIGITOXIGENIN,(3-BETA-OH,5-BETA-H)
CAS Registry Number 143-62-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O4
InChI InChI=1S/C23H34O4/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/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23+/m1/s1
InChIKey XZTUSOXSLKTKJQ-CESUGQOBSA-N
Literature Reference Author D.KRUEGER,M.WICHTL
Literature Reference Citation PLANTA.MED.,50,267(1984)
Literature Reference DOI 10.1055/s-2007-969697
Molecular Weight 374.521 g/mol
Solvent CDCl3:CD3OD
Source File Reference UNIW8421