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3-O-BETA-[GALACTOPYRANOSYL-(1->2)-[XYLOPYRANOSYL-(1->3)]-[6-BUTYL]-GLUCURONOPYRANOSYL]-QUILLAIC-ACID
SpectraBase Compound ID EeUMJGlk4fS
InChI InChI=1S/C51H80O20/c1-8-9-18-65-41(62)39-37(61)38(69-42-35(59)32(56)26(54)22-66-42)40(71-43-36(60)34(58)33(57)27(21-52)67-43)44(70-39)68-31-13-14-47(4)28(48(31,5)23-53)12-15-49(6)29(47)11-10-24-25-19-46(2,3)16-17-51(25,45(63)64)30(55)20-50(24,49)7/h10,23,25-40,42-44,52,54-61H,8-9,11-22H2,1-7H3,(H,63,64)/t25?,26-,27+,28?,29?,30-,31+,32+,33-,34-,35-,36+,37+,38+,39?,40-,42+,43-,44-,47+,48+,49-,50-,51-/m1/s1
InChIKey JCJMROYTZOWAKV-BGOVLKSSSA-N
Mol Weight 1013.2 g/mol
Molecular Formula C51H80O20
Exact Mass 1012.524295 g/mol
Enantiomer InChIKey JCJMROYTZOWAKV-WFECQMTESA-N
Unknown Identification

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