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5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGNAN-4-OL

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5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGNAN-4-OL
SpectraBase Compound ID CLpV8owjeqn
InChI InChI=1S/C25H40O5/c1-22-11-9-20-18(19(22)6-7-21(22)24(3)27-14-15-28-24)8-12-25(29-16-17-30-25)23(20,2)10-4-5-13-26/h13,18-21H,4-12,14-17H2,1-3H3/t18-,19-,20-,21-,22-,23+/m0/s1
InChIKey PFNLCXNMHPOTJW-RCTKEMKKSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2UTTszkk4R
Name 5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGNAN-4-OL
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O5
InChI InChI=1S/C25H40O5/c1-22-11-9-20-18(19(22)6-7-21(22)24(3)27-14-15-28-24)8-12-25(29-16-17-30-25)23(20,2)10-4-5-13-26/h13,18-21H,4-12,14-17H2,1-3H3/t18-,19-,20-,21-,22-,23+/m0/s1
InChIKey PFNLCXNMHPOTJW-RCTKEMKKSA-N
Literature Reference Author M.HAASE-HELD,M.HATZIS,J.MANN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2907(1993)
Literature Reference DOI 10.1039/p19930002907
Molecular Weight 420.590 g/mol
Solvent CDCl3
Source File Reference UWCS18952