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(25S)-26-Methyl-24-methylene-cholest-4-en-3-one
SpectraBase Compound ID DFA1hvynifJ
InChI InChI=1S/C29H46O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h18-19,21,24-27H,3,7-17H2,1-2,4-6H3/t19-,21+,24-,25+,26-,27-,28-,29+/m0/s1
InChIKey DHYHZNDBOUPDGR-PQVDILGLSA-N
Mol Weight 410.7 g/mol
Molecular Formula C29H46O
Exact Mass 410.354866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2LApSFFIHO4
Name (25S)-26-METHYLENE-CHOLEST-4-EN-3-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H46O
InChI InChI=1S/C29H46O/c1-7-19(2)20(3)8-9-21(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h18-19,21,24-27H,3,7-17H2,1-2,4-6H3/t19-,21+,24-,25+,26-,27-,28-,29+/m0/s1
InChIKey DHYHZNDBOUPDGR-PQVDILGLSA-N
Literature Reference Author S.TANG,R.XU,W.LIN,H.DUAN
Literature Reference Citation REC.NAT.PROD.,6,398(2012)
Molecular Weight 410.684 g/mol
Solvent CDCl3
Source File Reference UWBT15270