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(20-S,22-E)-20-HYDROXY-24-NORCHOLESTA-1,4,22-TRIEN-3-ONE
SpectraBase Compound ID 3GKtPIr7RZT
InChI InChI=1S/C26H38O2/c1-17(2)10-15-26(5,28)23-9-8-21-20-7-6-18-16-19(27)11-13-24(18,3)22(20)12-14-25(21,23)4/h10-11,13,15-17,20-23,28H,6-9,12,14H2,1-5H3/b15-10+/t20-,21-,22-,23-,24-,25-,26?/m0/s1
InChIKey LVAWHQSFUBLRSU-FURGYYGCSA-N
Mol Weight 382.6 g/mol
Molecular Formula C26H38O2
Exact Mass 382.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ab7y4MdEphy
Name (20-S,22-E)-20-HYDROXY-24-NORCHOLESTA-1,4,22-TRIEN-3-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38O2
InChI InChI=1S/C26H38O2/c1-17(2)10-15-26(5,28)23-9-8-21-20-7-6-18-16-19(27)11-13-24(18,3)22(20)12-14-25(21,23)4/h10-11,13,15-17,20-23,28H,6-9,12,14H2,1-5H3/b15-10+/t20-,21-,22-,23-,24-,25-,26?/m0/s1
InChIKey LVAWHQSFUBLRSU-FURGYYGCSA-N
Literature Reference Author G.G.MELLADO,E.ZUBIA,M.J.ORTEGA,P.J.LOPEZ-GONZALEZ
Literature Reference Citation J.NAT.PROD.,68,1111(2005)
Literature Reference DOI 10.1021/np050080q
Molecular Weight 382.587 g/mol
Solvent CDCl3
Source File Reference UWMZ12138