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7,4'-Diacetoxy-5-(hydroxy-8-C-prenylisoflavone
SpectraBase Compound ID J9zmUb4Dccz
InChI InChI=1S/C24H22O7/c1-13(2)5-10-18-21(31-15(4)26)11-20(27)22-23(28)19(12-29-24(18)22)16-6-8-17(9-7-16)30-14(3)25/h5-9,11-12,27H,10H2,1-4H3
InChIKey ADXUAAGHBXTKCJ-UHFFFAOYSA-N
Mol Weight 422.43 g/mol
Molecular Formula C24H22O7
Exact Mass 422.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5exKPvM718
Name 7,4'-Diacetoxy-5-(hydroxy-8-C-prenylisoflavone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.136553041 u
Formula C24H22O7
InChI InChI=1S/C24H22O7/c1-13(2)5-10-18-21(31-15(4)26)11-20(27)22-23(28)19(12-29-24(18)22)16-6-8-17(9-7-16)30-14(3)25/h5-9,11-12,27H,10H2,1-4H3
InChIKey ADXUAAGHBXTKCJ-UHFFFAOYSA-N
Molecular Weight 422.433 g/mol
SMILES C1=2C(C(C3=CC=C(OC(=O)C)C=C3)=COC1=C(C(OC(=O)C)=CC2O)CC=C(C)C)=O