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4',5-DIHYDROXY-7-O-METHYL-ISOFLAVONE-3'-O-BETA-D-(3''-E-CINNAMOYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID GReXkPCckYg
InChI InChI=1S/C31H28O12/c1-39-18-12-21(34)26-23(13-18)40-15-19(27(26)36)17-8-9-20(33)22(11-17)41-31-29(38)30(28(37)24(14-32)42-31)43-25(35)10-7-16-5-3-2-4-6-16/h2-13,15,24,28-34,37-38H,14H2,1H3/b10-7+/t24-,28-,29-,30+,31-/m1/s1
InChIKey NZDCPGVUPNQJKH-NASVKGIYSA-N
Mol Weight 592.55 g/mol
Molecular Formula C31H28O12
Exact Mass 592.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GXmgVqpM4ff
Name 4',5-DIHYDROXY-7-O-METHYL-ISOFLAVONE-3'-O-BETA-D-(3''-E-CINNAMOYL)-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28O12
InChI InChI=1S/C31H28O12/c1-39-18-12-21(34)26-23(13-18)40-15-19(27(26)36)17-8-9-20(33)22(11-17)41-31-29(38)30(28(37)24(14-32)42-31)43-25(35)10-7-16-5-3-2-4-6-16/h2-13,15,24,28-34,37-38H,14H2,1H3/b10-7+/t24-,28-,29-,30+,31-/m1/s1
InChIKey NZDCPGVUPNQJKH-NASVKGIYSA-N
Literature Reference Author K.S.KRISHNAVENI,J.V.S.RAO
Literature Reference Citation CHEM.PHARM.BULL.,48,1373(2000)
Literature Reference DOI 10.1248/cpb.48.1373
Molecular Weight 592.556 g/mol
Solvent DMSO-D6
Source File Reference UWVN4524