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3,4,6-TRIS-O-ACETYL-1',2,3',4',6'-PENTAKIS-O-(3-METHYLBUTANOYL)-BETA-D-FRUCTOFURANOSYL-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID BxzBon0x5Vn
InChI InChI=1S/C43H68O19/c1-22(2)14-32(47)53-20-31-38(58-34(49)16-24(5)6)41(60-36(51)18-26(9)10)43(61-31,21-54-33(48)15-23(3)4)62-42-40(59-35(50)17-25(7)8)39(56-29(13)46)37(55-28(12)45)30(57-42)19-52-27(11)44/h22-26,30-31,37-42H,14-21H2,1-13H3/t30-,31-,37-,38-,39+,40-,41+,42-,43+/m0/s1
InChIKey MHWIPVLMBBRHRI-YTIWXCFLSA-N
Mol Weight 889.0 g/mol
Molecular Formula C43H68O19
Exact Mass 888.43548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MogWw88di9
Name 3,4,6-TRIS-O-ACETYL-1',2,3',4',6'-PENTAKIS-O-(3-METHYLBUTANOYL)-BETA-D-FRUCTOFURANOSYL-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H68O19
InChI InChI=1S/C43H68O19/c1-22(2)14-32(47)53-20-31-38(58-34(49)16-24(5)6)41(60-36(51)18-26(9)10)43(61-31,21-54-33(48)15-23(3)4)62-42-40(59-35(50)17-25(7)8)39(56-29(13)46)37(55-28(12)45)30(57-42)19-52-27(11)44/h22-26,30-31,37-42H,14-21H2,1-13H3/t30-,31-,37-,38-,39+,40-,41+,42-,43+/m0/s1
InChIKey MHWIPVLMBBRHRI-YTIWXCFLSA-N
Literature Reference Author A.T.TCHINDA,P.TANE,J.F.AYAFOR,J.D.CONOLLY
Literature Reference Citation PHYTOCHEM.,63,841(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00326-1
Molecular Weight 889.002 g/mol
Solvent CDCl3
Source File Reference UWVN27133