John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=H6mlSw1A3iO SpectraBase Spectrum ID=JygmAgvFoHF

(accessed ).
ROEPERANONE;1,3,5,6-TETRAHYDROXY-4-TRANS-SESQUILAVANDULYLXANTHONE
SpectraBase Compound ID H6mlSw1A3iO
InChI InChI=1S/C28H32O6/c1-15(2)7-6-8-17(5)9-10-18(16(3)4)13-20-22(30)14-23(31)24-25(32)19-11-12-21(29)26(33)28(19)34-27(20)24/h7,9,11-12,14,18,29-31,33H,3,6,8,10,13H2,1-2,4-5H3/b17-9+
InChIKey JTTFEYFSONRJOU-RQZCQDPDSA-N
Mol Weight 464.6 g/mol
Molecular Formula C28H32O6
Exact Mass 464.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JygmAgvFoHF
Name ROEPERANONE;1,3,5,6-TETRAHYDROXY-4-TRANS-SESQUILAVANDULYLXANTHONE
Compound Number 9
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H32O6
InChI InChI=1S/C28H32O6/c1-15(2)7-6-8-17(5)9-10-18(16(3)4)13-20-22(30)14-23(31)24-25(32)19-11-12-21(29)26(33)28(19)34-27(20)24/h7,9,11-12,14,18,29-31,33H,3,6,8,10,13H2,1-2,4-5H3/b17-9+
InChIKey JTTFEYFSONRJOU-RQZCQDPDSA-N
Literature Reference Author G.RATH,O.POTTERAT,S.MAVI,K.HOSTETTMANN
Literature Reference Citation PHYTOCHEM.,43,513(1996)
Literature Reference DOI 10.1016/0031-9422(96)00284-1
Molecular Weight 464.558 g/mol
Solvent ACETONE-D6
Source File Reference UWMS2049
SpectraBase Batch ID C6kigW3ASVu