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2-(3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)-3,5,7-trihydroxy-8-(2-methylbut-3-en-2-yl)-4H-chromen-4-one

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

2-(3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)-3,5,7-trihydroxy-8-(2-methylbut-3-en-2-yl)-4H-chromen-4-one
SpectraBase Compound ID 1rryuoKcwKY
InChI InChI=1S/C25H26O7/c1-6-25(4,5)19-16(27)11-15(26)18-21(30)22(31)23(32-24(18)19)14-9-13(8-7-12(2)3)20(29)17(28)10-14/h6-7,9-11,26-29,31H,1,8H2,2-5H3
InChIKey XCKYBRFHABGHMT-UHFFFAOYSA-N
Mol Weight 438.48 g/mol
Molecular Formula C25H26O7
Exact Mass 438.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4EvC9PuqmJD
Name 2-(3,4-Dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl)-3,5,7-trihydroxy-8-(2-methylbut-3-en-2-yl)-4H-chromen-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.167853170 u
Formula C25H26O7
InChI InChI=1S/C25H26O7/c1-6-25(4,5)19-16(27)11-15(26)18-21(30)22(31)23(32-24(18)19)14-9-13(8-7-12(2)3)20(29)17(28)10-14/h6-7,9-11,26-29,31H,1,8H2,2-5H3
InChIKey XCKYBRFHABGHMT-UHFFFAOYSA-N
Molecular Weight 438.476 g/mol
SMILES C1(=C(C(=O)C=2C(=CC(=C(C2O1)C(C=C)(C)C)O)O)O)C=1C=C(C(=C(C1)CC=C(C)C)O)O