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3-BETA,19-DIACETOXYPREGNAN-2,16-DIONE

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3-BETA,19-DIACETOXYPREGNAN-2,16-DIONE
SpectraBase Compound ID 8tpuzzZtdfL
InChI InChI=1S/C25H36O6/c1-5-18-21(28)11-20-17-7-6-16-10-23(31-15(3)27)22(29)12-25(16,13-30-14(2)26)19(17)8-9-24(18,20)4/h16-20,23H,5-13H2,1-4H3/t16?,17?,18-,19?,20?,23+,24+,25+/m0/s1
InChIKey ZFTUVYVXVWUVOQ-WNYUZHBHSA-N
Mol Weight 432.6 g/mol
Molecular Formula C25H36O6
Exact Mass 432.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOHw9pmWdVQ
Name 3-BETA,19-DIACETOXYPREGNAN-2,16-DIONE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O6
InChI InChI=1S/C25H36O6/c1-5-18-21(28)11-20-17-7-6-16-10-23(31-15(3)27)22(29)12-25(16,13-30-14(2)26)19(17)8-9-24(18,20)4/h16-20,23H,5-13H2,1-4H3/t16?,17?,18-,19?,20?,23+,24+,25+/m0/s1
InChIKey ZFTUVYVXVWUVOQ-WNYUZHBHSA-N
Literature Reference Author M.T.PUPO,P.C.VIEIRA,J.B.FERNANDES,M.F.D.G.F.DASILVA,E.R.FO
Literature Reference Citation PHYTOCHEM.,45,1495(1997)
Literature Reference DOI 10.1016/S0031-9422(97)00167-2
Molecular Weight 432.557 g/mol
Solvent CDCl3
Source File Reference UWSP304