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1,2'-DISINAPOYL-2-FERULOYLGENTIOBIOSE;6-O-BETA-D-(2'-O-SINAPOYL)-GLUCOPYRANOSYL-BETA-D-(1-O-SINAPOYL,2-O-FERULOYL)-GLUCOPYRANOSE
SpectraBase Compound ID 6pfZWooe0No
InChI InChI=1S/C44H50O22/c1-56-25-14-21(6-10-24(25)46)7-11-32(47)65-42-40(55)38(53)31(63-44(42)66-34(49)13-9-23-17-28(59-4)36(51)29(18-23)60-5)20-61-43-41(39(54)37(52)30(19-45)62-43)64-33(48)12-8-22-15-26(57-2)35(50)27(16-22)58-3/h6-18,30-31,37-46,50-55H,19-20H2,1-5H3/b11-7+,12-8+,13-9+/t30-,31+,37-,38+,39+,40-,41-,42+,43-,44-/m0/s1
InChIKey AZUSMVXIHUPOCX-HQPDAFFESA-N
Mol Weight 930.9 g/mol
Molecular Formula C44H50O22
Exact Mass 930.279373 g/mol
Enantiomer InChIKey AZUSMVXIHUPOCX-NUTHXXHBSA-N
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