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(5Z,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3,25-TRIOL
SpectraBase Compound ID EWfkWh7OzqJ
InChI InChI=1S/C27H43FO3/c1-18(7-5-13-26(2,3)31)23-11-12-24-19(8-6-14-27(23,24)4)9-10-20-15-21(29)16-25(30)22(20)17-28/h9-10,17-18,21,23-25,29-31H,5-8,11-16H2,1-4H3/b19-9+,20-10-,22-17+/t18?,21-,23?,24?,25+,27?/m1/s1
InChIKey FYKDFTBGRZTDCR-CDZMFGQQSA-N
Mol Weight 434.6 g/mol
Molecular Formula C27H43FO3
Exact Mass 434.319623 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IgXlvlWy8b2
Name (5Z,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3,25-TRIOL
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H43FO3
InChI InChI=1S/C27H43FO3/c1-18(7-5-13-26(2,3)31)23-11-12-24-19(8-6-14-27(23,24)4)9-10-20-15-21(29)16-25(30)22(20)17-28/h9-10,17-18,21,23-25,29-31H,5-8,11-16H2,1-4H3/b19-9+,20-10-,22-17+/t18?,21-,23?,24?,25+,27?/m1/s1
InChIKey FYKDFTBGRZTDCR-CDZMFGQQSA-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 UWVN4631