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TOPSENTISTEROL_D3;(22-E,24-S)-3-BETA-HYDROXY-24-METHYLCHOLESTA-5,8,22-TRIEN-7-ONE

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TOPSENTISTEROL_D3;(22-E,24-S)-3-BETA-HYDROXY-24-METHYLCHOLESTA-5,8,22-TRIEN-7-ONE
SpectraBase Compound ID E82cVo8wMuO
InChI InChI=1S/C28H42O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-26-24(12-14-28(22,23)6)27(5)13-11-21(29)15-20(27)16-25(26)30/h7-8,16-19,21-23,29H,9-15H2,1-6H3/b8-7+/t18-,19+,21-,22+,23-,27-,28+/m0/s1
InChIKey UOHNARRKDSHFLD-ZYOSRWINSA-N
Mol Weight 410.6 g/mol
Molecular Formula C28H42O2
Exact Mass 410.318481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIsHKJnTvOS
Name 3-BETA-HYDROXY-(22E,24R)-ERGOSTA-5,8,22-TRIEN-7-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O2
InChI InChI=1S/C28H42O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-26-24(12-14-28(22,23)6)27(5)13-11-21(29)15-20(27)16-25(26)30/h7-8,16-19,21-23,29H,9-15H2,1-6H3/b8-7+/t18-,19+,21-,22+,23-,27-,28+/m0/s1
InChIKey UOHNARRKDSHFLD-ZYOSRWINSA-N
Literature Reference Author T.ISHIZUKA,Y.YAOITA,M.KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,45,1756(1997)
Literature Reference DOI 10.1248/cpb.45.1756
Molecular Weight 410.640 g/mol
Solvent CDCl3
Source File Reference UWVN28954