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8-C-BETA-(2''-O-BETA-GLUCOPYRANOSYL)-GLUCOPYRANOSYL-7,4'-DI-O-METHYL-APIGENINIDIN;MAJOR-ISOMER
SpectraBase Compound ID 7HxP71rJzeS
InChI InChI=1S/C29H34O14/c1-38-13-5-3-12(4-6-13)16-8-7-14-15(32)9-17(39-2)20(26(14)40-16)27-28(24(36)22(34)18(10-30)41-27)43-29-25(37)23(35)21(33)19(11-31)42-29/h3-9,18-19,21-25,27-31,33-37H,10-11H2,1-2H3/p+1/t18-,19-,21-,22-,23+,24+,25-,27+,28-,29+/m1/s1
InChIKey NEUSUDFVJBSWKP-SFBYTARZSA-O
Mol Weight 607.6 g/mol
Molecular Formula C29H35O14
Exact Mass 607.202681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4mrdVtGQwqR
Name 8-C-BETA-(2''-O-BETA-GLUCOPYRANOSYL)-GLUCOPYRANOSYL-7,4'-DI-O-METHYL-APIGENINIDIN;MAJOR-ISOMER
Compound Number 4(8)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H35O14
InChI InChI=1S/C29H34O14/c1-38-13-5-3-12(4-6-13)16-8-7-14-15(32)9-17(39-2)20(26(14)40-16)27-28(24(36)22(34)18(10-30)41-27)43-29-25(37)23(35)21(33)19(11-31)42-29/h3-9,18-19,21-25,27-31,33-37H,10-11H2,1-2H3/p+1/t18-,19-,21-,22-,23+,24+,25-,27+,28-,29+/m1/s1
InChIKey NEUSUDFVJBSWKP-SFBYTARZSA-O
Literature Reference Author O.BROROY,S.RAYYAN,T.FOSSEN,O.M.ANDERSEN
Literature Reference Citation J.AGR.FOOD.CHEM.,57,6668(2009)
Literature Reference DOI 10.1021/jf900759q
Molecular Weight 607.588 g/mol
Sample ID 68066
Solvent CF3COOD:CD3OD=5:95