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(24-S)-24-ETHYL-3-OXO-CHOLESTA-4,25-DIEN-6-BETA-OL
SpectraBase Compound ID 1gijQOGkl3s
InChI InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,19-20,22-25,27,31H,2,7-15,17H2,1,3-6H3/t19-,20-,22+,23-,24+,25+,27-,28-,29-/m1/s1
InChIKey AENJXYQUUKMTKX-NFVQQQKOSA-N
Mol Weight 426.7 g/mol
Molecular Formula C29H46O2
Exact Mass 426.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMaeC5twl6y
Name (24-S)-24-ETHYL-3-OXO-CHOLESTA-4,25-DIEN-6-BETA-OL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H46O2
InChI InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,19-20,22-25,27,31H,2,7-15,17H2,1,3-6H3/t19-,20-,22+,23-,24+,25+,27-,28-,29-/m1/s1
InChIKey AENJXYQUUKMTKX-NFVQQQKOSA-N
Literature Reference Author J.H.SHEU,C.C.LIAW,C.Y.DUH
Literature Reference Citation J.NAT.PROD.,58,1521(1995)
Literature Reference DOI 10.1021/np50124a007
Molecular Weight 426.683 g/mol
Solvent CDCl3
Source File Reference UWRU583