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4',4'",5,5'',7,7''-Hexamethoxy-3',3'''-biflavone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4',4'",5,5'',7,7''-Hexamethoxy-3',3'''-biflavone
SpectraBase Compound ID JXhBW3KwW2l
InChI InChI=1S/C36H30O10/c1-39-21-13-31(43-5)35-25(37)17-29(45-33(35)15-21)19-7-9-27(41-3)23(11-19)24-12-20(8-10-28(24)42-4)30-18-26(38)36-32(44-6)14-22(40-2)16-34(36)46-30/h7-18H,1-6H3
InChIKey ZFAGBRDORCUZIM-UHFFFAOYSA-N
Mol Weight 622.6 g/mol
Molecular Formula C36H30O10
Exact Mass 622.183897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hlcBjDNZfW
Name 4',4''',5,5'',7,7''-hexamethoxy-3',3'''-biflavone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 622.183897156 u
Formula C36H30O10
InChI InChI=1S/C36H30O10/c1-39-21-13-31(43-5)35-25(37)17-29(45-33(35)15-21)19-7-9-27(41-3)23(11-19)24-12-20(8-10-28(24)42-4)30-18-26(38)36-32(44-6)14-22(40-2)16-34(36)46-30/h7-18H,1-6H3
InChIKey ZFAGBRDORCUZIM-UHFFFAOYSA-N
Molecular Weight 622.626 g/mol
SMILES C=12C(C=C(C3=CC(C=4C=C(C5=CC(C=6C(=CC(=CC6O5)OC)OC)=O)C=CC4OC)=C(C=C3)OC)OC2=CC(=CC1OC)OC)=O