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

*Links on SpectraBase are not permalinks.
KAEMPFEROL-3-O-BETA-D-[6'''-O-(E)-CAFFEOYL]-GLUCOPYRANOSYL-(1'''->2'')-O-ALPHA-L-ARABINOPYRANOSIDE-7-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID FSC4EMnzo8y
InChI InChI=1S/C41H44O23/c42-12-24-29(50)32(53)34(55)39(61-24)59-18-10-21(46)27-23(11-18)60-36(16-3-5-17(43)6-4-16)37(31(27)52)63-41-38(28(49)22(47)13-58-41)64-40-35(56)33(54)30(51)25(62-40)14-57-26(48)8-2-15-1-7-19(44)20(45)9-15/h1-11,22,24-25,28-30,32-35,38-47,49-51,53-56H,12-14H2/b8-2+/t22-,24-,25+,28-,29-,30+,32+,33-,34-,35+,38+,39-,40-,41-/m0/s1
InChIKey RRLHNNHGOHUCNW-AUQAVNQESA-N
Mol Weight 904.8 g/mol
Molecular Formula C41H44O23
Exact Mass 904.227338 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 GrNgLZu0A5M
Name KAEMPFEROL-3-O-BETA-D-[6'''-O-(E)-CAFFEOYL]-GLUCOPYRANOSYL-(1'''->2'')-O-ALPHA-L-ARABINOPYRANOSIDE-7-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H44O23
InChI InChI=1S/C41H44O23/c42-12-24-29(50)32(53)34(55)39(61-24)59-18-10-21(46)27-23(11-18)60-36(16-3-5-17(43)6-4-16)37(31(27)52)63-41-38(28(49)22(47)13-58-41)64-40-35(56)33(54)30(51)25(62-40)14-57-26(48)8-2-15-1-7-19(44)20(45)9-15/h1-11,22,24-25,28-30,32-35,38-47,49-51,53-56H,12-14H2/b8-2+/t22-,24-,25+,28-,29-,30+,32+,33-,34-,35+,38+,39-,40-,41-/m0/s1
InChIKey RRLHNNHGOHUCNW-AUQAVNQESA-N
Literature Reference Author F.GELLER,R.MURILLO,L.STEINHAUSER,B.HEINZMANN,K.ALBERT,I.MERF ORT,S.LAUFER
Literature Reference Citation MOLECULES,19,6727(2014)
Literature Reference DOI 10.3390/molecules19056727
Molecular Weight 904.787 g/mol
Solvent C5D5N
Source File Reference UWIR14523