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BETA-D-[1-O-ACETYL-3,6-DI-O-(4-O-ACETYL-FERULOYL)]-FRUCTOFURANOSYL-ALPHA-D-(2',3',4',6'-TETRA-O-ACETYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID Hbg6KOCNtMK
InChI InChI=1S/C48H54O25/c1-24(49)61-21-38-42(66-28(5)53)44(68-30(7)55)45(69-31(8)56)47(70-38)73-48(23-63-25(2)50)46(71-41(58)18-14-33-12-16-35(65-27(4)52)37(20-33)60-10)43(67-29(6)54)39(72-48)22-62-40(57)17-13-32-11-15-34(64-26(3)51)36(19-32)59-9/h11-20,38-39,42-47H,21-23H2,1-10H3/b17-13+,18-14+/t38-,39+,42-,43+,44+,45-,46-,47-,48-/m1/s1
InChIKey NXLBRBRBPMGGBY-GFBAJSILSA-N
Mol Weight 1030.9 g/mol
Molecular Formula C48H54O25
Exact Mass 1030.295417 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HRNUDDsHOwc
Name BETA-D-[1-O-ACETYL-3,6-DI-O-(4-O-ACETYL-FERULOYL)]-FRUCTOFURANOSYL-ALPHA-D-(2',3',4',6'-TETRA-O-ACETYL)-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H54O25
InChI InChI=1S/C48H54O25/c1-24(49)61-21-38-42(66-28(5)53)44(68-30(7)55)45(69-31(8)56)47(70-38)73-48(23-63-25(2)50)46(71-41(58)18-14-33-12-16-35(65-27(4)52)37(20-33)60-10)43(67-29(6)54)39(72-48)22-62-40(57)17-13-32-11-15-34(64-26(3)51)36(19-32)59-9/h11-20,38-39,42-47H,21-23H2,1-10H3/b17-13+,18-14+/t38-,39+,42-,43+,44+,45-,46-,47-,48-/m1/s1
InChIKey NXLBRBRBPMGGBY-GFBAJSILSA-N
Literature Reference Author L.J.HARRISON,G.L.SIA,K.Y.SIM,H.T.W.TAN,J.D.CONNOLLY,C.LAVAUD ,G.MASSIOT
Literature Reference Citation PHYTOCHEM.,38,1497(1995)
Literature Reference DOI 10.1016/0031-9422(94)00314-J
Molecular Weight 1030.942 g/mol
Solvent Unknown
Source File Reference UWMS4070