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5-O-[[5''-O-(E)-(4'''-O-THREO-GUAIACYL-GLYCEROL)-FERULOYL]-BETA-APIOFURANOSYL-(1->2)-BETA-XYLOPYRANOSYL]-GENTISIC-ACID
SpectraBase Compound ID 3VViYHk82gc
InChI InChI=1S/C37H42O19/c1-49-26-12-19(5-7-23(26)40)30(43)28(14-38)55-25-9-3-18(11-27(25)50-2)4-10-29(42)52-16-37(48)17-53-36(33(37)45)56-32-31(44)24(41)15-51-35(32)54-20-6-8-22(39)21(13-20)34(46)47/h3-13,24,28,30-33,35-36,38-41,43-45,48H,14-17H2,1-2H3,(H,46,47)/b10-4+/t24-,28?,30?,31+,32-,33+,35+,36+,37-/m1/s1
InChIKey DQUIAEQXPXEISI-YUQZMJHKSA-N
Mol Weight 790.7 g/mol
Molecular Formula C37H42O19
Exact Mass 790.232029 g/mol
Enantiomer InChIKey DQUIAEQXPXEISI-RLUACMMSSA-N
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