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(6S,19S)-SULFONYL-(5Z,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3-DIOL

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(6S,19S)-SULFONYL-(5Z,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3-DIOL
SpectraBase Compound ID Cu9KWGI8Iow
InChI InChI=1S/C27H43FO4S/c1-16(2)7-5-8-17(3)21-10-11-22-18(9-6-12-27(21,22)4)13-24-20-14-19(29)15-23(30)25(20)26(28)33(24,31)32/h13,16-17,19,21-24,26,29-30H,5-12,14-15H2,1-4H3/b18-13+/t17?,19-,21?,22?,23+,24+,26+,27?/m0/s1
InChIKey MOWABURTLZEWKN-WVNOTSTGSA-N
Mol Weight 482.7 g/mol
Molecular Formula C27H43FO4S
Exact Mass 482.286609 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID fT30GG4ezE
Name (6S,19S)-SULFONYL-(5Z,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3-DIOL
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H43FO4S
InChI InChI=1S/C27H43FO4S/c1-16(2)7-5-8-17(3)21-10-11-22-18(9-6-12-27(21,22)4)13-24-20-14-19(29)15-23(30)25(20)26(28)33(24,31)32/h13,16-17,19,21-24,26,29-30H,5-12,14-15H2,1-4H3/b18-13+/t17?,19-,21?,22?,23+,24+,26+,27?/m0/s1
InChIKey MOWABURTLZEWKN-WVNOTSTGSA-N
Literature Reference Author M.SHIMIZU,Y.IWASAKI,A.OHNO,S.YAMADA
Literature Reference Citation CHEM.PHARM.BULL.,48,1484(2000)
Literature Reference DOI 10.1248/cpb.48.1484
Solvent CDCl3
Source File Reference UWVN4613