For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4,5,8-TRIHYDROXY-ALPHA-TETRALONE-5-O-BETA-D-[6'-O-(3'',5''-DIMETHOXY-4''-HYDROXYBENZOYL)]-GLUCOPYRANOSIDE
SpectraBase Compound ID BaODqvfrBHP
InChI InChI=1S/C25H28O13/c1-34-15-7-10(8-16(35-2)20(15)29)24(33)36-9-17-21(30)22(31)23(32)25(38-17)37-14-6-5-12(27)18-11(26)3-4-13(28)19(14)18/h5-8,13,17,21-23,25,27-32H,3-4,9H2,1-2H3/t13?,17-,21-,22+,23-,25-/m1/s1
InChIKey BMMIPVIWXSFRLN-LQFICADKSA-N
Mol Weight 536.49 g/mol
Molecular Formula C25H28O13
Exact Mass 536.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9kOvyhikhb6
Name 4,5,8-TRIHYDROXY-ALPHA-TETRALONE-5-O-BETA-D-[6'-O-(3'',5''-DIMETHOXY-4''-HYDROXYBENZOYL)]-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O13
InChI InChI=1S/C25H28O13/c1-34-15-7-10(8-16(35-2)20(15)29)24(33)36-9-17-21(30)22(31)23(32)25(38-17)37-14-6-5-12(27)18-11(26)3-4-13(28)19(14)18/h5-8,13,17,21-23,25,27-32H,3-4,9H2,1-2H3/t13?,17-,21-,22+,23-,25-/m1/s1
InChIKey BMMIPVIWXSFRLN-LQFICADKSA-N
Literature Reference Author S.H.KIM,K.S.LEE,J.K.SON,G.H.JE,J.S.LEE,C.H.LEE,C.J.CHEONG
Literature Reference Citation J.NAT.PROD.,61,643(1998)
Literature Reference DOI 10.1021/np970413m
Molecular Weight 536.490 g/mol
Solvent CD3OD
Source File Reference UWRK3405