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(22E)-CHOLESTA-4,6,8(14),22-TETRAEN-3-ONE

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(22E)-CHOLESTA-4,6,8(14),22-TETRAEN-3-ONE
SpectraBase Compound ID JoKoZrULdWr
InChI InChI=1S/C27H38O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8-10,17-19,23,25H,7,11-16H2,1-5H3/b8-6+/t19-,23-,25+,26+,27-/m1/s1
InChIKey AJRNPFZYKICTEM-AQAVSRJYSA-N
Mol Weight 378.6 g/mol
Molecular Formula C27H38O
Exact Mass 378.292266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BkwC2GZLO8
Name (22E)-CHOLESTA-4,6,8(14),22-TETRAEN-3-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O
InChI InChI=1S/C27H38O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8-10,17-19,23,25H,7,11-16H2,1-5H3/b8-6+/t19-,23-,25+,26+,27-/m1/s1
InChIKey AJRNPFZYKICTEM-AQAVSRJYSA-N
Literature Reference Author P.CIMINIELLO,E.FATTORUSSO,S.MAGNO,A.MANGONI,M.PANSINI
Literature Reference Citation J.NAT.PROD.,52,1331(1989)
Literature Reference DOI 10.1021/np50066a026
Molecular Weight 378.598 g/mol
Solvent CDCl3
Source File Reference UWED17880