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8-E-BROMOMETHYLENE-(20-S,23-S)-EPOXYMETHANO-25-HYDROXYDES-A,B-CHOLESTA-8-ONE
SpectraBase Compound ID Kl50Gr9qweu
InChI InChI=1S/C20H33BrO2/c1-18(2,22)10-14-11-20(4,23-13-14)17-8-7-16-15(12-21)6-5-9-19(16,17)3/h12,14,16-17,22H,5-11,13H2,1-4H3/b15-12+/t14-,16-,17-,19-,20+/m0/s1
InChIKey PVEYREBAHVBVRV-VJRBAMRESA-N
Mol Weight 385.4 g/mol
Molecular Formula C20H33BrO2
Exact Mass 384.166393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EEngyn3FfyG
Name 8-E-BROMOMETHYLENE-(20-S,23-S)-EPOXYMETHANO-25-HYDROXYDES-A,B-CHOLESTA-8-ONE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H33BrO2
InChI InChI=1S/C20H33BrO2/c1-18(2,22)10-14-11-20(4,23-13-14)17-8-7-16-15(12-21)6-5-9-19(16,17)3/h12,14,16-17,22H,5-11,13H2,1-4H3/b15-12+/t14-,16-,17-,19-,20+/m0/s1
InChIKey PVEYREBAHVBVRV-VJRBAMRESA-N
Literature Reference Author P.ANTONY,R.SIGUEEIRO,T.HUET,Y.SATO,N.RAMALANJAONA,L.C.RODRIG UES,A.MOURINO,D.MORA
Literature Reference Citation J.MED.CHEM.,53,1159(2010)
Literature Reference DOI 10.1021/jm9014636
Molecular Weight 385.385 g/mol
Solvent CDCl3
Source File Reference UWMZ46269