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

View entire compound with spectra: 1 NMR

(5E,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3-DIOL
SpectraBase Compound ID AeRIn76ZHY4
InChI InChI=1S/C27H43FO2/c1-18(2)7-5-8-19(3)24-12-13-25-20(9-6-14-27(24,25)4)10-11-21-15-22(29)16-26(30)23(21)17-28/h10-11,17-19,22,24-26,29-30H,5-9,12-16H2,1-4H3/b20-10+,21-11+,23-17+/t19?,22-,24?,25?,26+,27?/m1/s1
InChIKey SDBKJGWYBRQPAF-CFRYALSRSA-N
Mol Weight 418.6 g/mol
Molecular Formula C27H43FO2
Exact Mass 418.324709 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6NDTkSSCSHJ
Name (5E,7E,10E)-19-FLUORO-9,10-SECO-5,7,10(19)-CHOLESTATRIENE-1,3-DIOL
Compound Number 12B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H43FO2
InChI InChI=1S/C27H43FO2/c1-18(2)7-5-8-19(3)24-12-13-25-20(9-6-14-27(24,25)4)10-11-21-15-22(29)16-26(30)23(21)17-28/h10-11,17-19,22,24-26,29-30H,5-9,12-16H2,1-4H3/b20-10+,21-11+,23-17+/t19?,22-,24?,25?,26+,27?/m1/s1
InChIKey SDBKJGWYBRQPAF-CFRYALSRSA-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 UWVN4621