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DEMETHYLPAXANTHONIN;1,3,5,6-TETRAHYDROXY-2-(2',2'-DIMETHYL-4'-ISOPROPYL)-CYCLOPENTANYL-XANTHEN-9-ONE
SpectraBase Compound ID 6SKxIQU1qsD
InChI InChI=1S/C23H24O6/c1-10(2)11-7-13(23(3,4)9-11)17-15(25)8-16-18(21(17)28)19(26)12-5-6-14(24)20(27)22(12)29-16/h5-6,8,11,13,24-25,27-28H,1,7,9H2,2-4H3/t11-,13+/m1/s1
InChIKey LYMUFMGSOHLCHO-YPMHNXCESA-N
Mol Weight 396.44 g/mol
Molecular Formula C23H24O6
Exact Mass 396.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LvupXqvGfwO
Name DEMETHYLPAXANTHONIN;1,3,5,6-TETRAHYDROXY-2-(2',2'-DIMETHYL-4'-ISOPROPYL)-CYCLOPENTANYL-XANTHEN-9-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H24O6
InChI InChI=1S/C23H24O6/c1-10(2)11-7-13(23(3,4)9-11)17-15(25)8-16-18(21(17)28)19(26)12-5-6-14(24)20(27)22(12)29-16/h5-6,8,11,13,24-25,27-28H,1,7,9H2,2-4H3/t11-,13+/m1/s1
InChIKey LYMUFMGSOHLCHO-YPMHNXCESA-N
Literature Reference Author K.ISHIGURO,H.FUKUMOTO,A.SUITANI,M.NAKAJIMA,K.ISOI
Literature Reference Citation PHYTOCHEM.,42,435(1996)
Literature Reference DOI 10.1016/0031-9422(95)00882-9
Molecular Weight 396.440 g/mol
Solvent CD3OD
Source File Reference UWLU3326