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

*Links on SpectraBase are not permalinks.
1-O-{6-O-[4-O-(6-O-SYRINGYLOYL-BETA-D-GLUCOPYRANOSYL)-VANILLOYL]-BETA-D-GLUCOPYRANOSYL}-2-METHOXY-PARA-HYDROXYQUINONE
SpectraBase Compound ID ARsrAsA4Hi7
InChI InChI=1S/C36H42O20/c1-47-20-9-15(33(45)51-13-24-27(39)29(41)32(44)36(55-24)54-19-8-6-17(37)12-21(19)48-2)5-7-18(20)53-35-31(43)30(42)28(40)25(56-35)14-52-34(46)16-10-22(49-3)26(38)23(11-16)50-4/h5-12,24-25,27-32,35-44H,13-14H2,1-4H3/t24-,25+,27-,28+,29+,30-,31+,32-,35+,36-/m1/s1
InChIKey SKIGPZMLTSBWRM-KIPUADAYSA-N
Mol Weight 794.7 g/mol
Molecular Formula C36H42O20
Exact Mass 794.226944 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 AIlHaPyYzIU
Name 1-O-{6-O-[4-O-(6-O-SYRINGYLOYL-BETA-D-GLUCOPYRANOSYL)-VANILLOYL]-BETA-D-GLUCOPYRANOSYL}-2-METHOXY-PARA-HYDROXYQUINONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H42O20
InChI InChI=1S/C36H42O20/c1-47-20-9-15(33(45)51-13-24-27(39)29(41)32(44)36(55-24)54-19-8-6-17(37)12-21(19)48-2)5-7-18(20)53-35-31(43)30(42)28(40)25(56-35)14-52-34(46)16-10-22(49-3)26(38)23(11-16)50-4/h5-12,24-25,27-32,35-44H,13-14H2,1-4H3/t24-,25+,27-,28+,29+,30-,31+,32-,35+,36-/m1/s1
InChIKey SKIGPZMLTSBWRM-KIPUADAYSA-N
Literature Reference Author Y.ZHANG,M.GAN,S.LIN,M.LIU,W.SONG,J.ZI,S.WANG,S.LI,Y.YANG,J.S HI
Literature Reference Citation J.NAT.PROD.,71,905(2008)
Literature Reference DOI 10.1021/np700758q
Molecular Weight 794.717 g/mol
Sample ID 28403
Solvent DMSO-D6