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METHYL-17-BETA-ACETOXY-3-METHOXY-14,17-ALPHA-ETHANOESTRA-1,3,5(10),15-TETRAENE-16-CARBOXYLATE
SpectraBase Compound ID 54yl7F8CNPU
InChI InChI=1S/C25H30O5/c1-15(26)30-25-12-11-24(14-21(25)22(27)29-4)20-8-5-16-13-17(28-3)6-7-18(16)19(20)9-10-23(24,25)2/h6-7,13-14,19-20H,5,8-12H2,1-4H3/t19?,20?,23-,24?,25+/m0/s1
InChIKey SWOWRKPFKVLBTE-OTMCQRRUSA-N
Mol Weight 410.51 g/mol
Molecular Formula C25H30O5
Exact Mass 410.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWH8xDTioxo
Name METHYL-17-BETA-ACETOXY-3-METHOXY-14,17-ALPHA-ETHANOESTRA-1,3,5(10),15-TETRAENE-16-CARBOXYLATE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O5
InChI InChI=1S/C25H30O5/c1-15(26)30-25-12-11-24(14-21(25)22(27)29-4)20-8-5-16-13-17(28-3)6-7-18(16)19(20)9-10-23(24,25)2/h6-7,13-14,19-20H,5,8-12H2,1-4H3/t19?,20?,23-,24?,25+/m0/s1
InChIKey SWOWRKPFKVLBTE-OTMCQRRUSA-N
Literature Reference Author J.R.BULL,C.HOADLEY,P.G.MOUNTFORD,L.M.STEER
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1179(1997)
Literature Reference DOI 10.1039/a606242c
Molecular Weight 410.510 g/mol
Solvent CDCl3
Source File Reference UWRU9837