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IIexoside XLIX (3-O-.beta.,D-galactopyranosyl(1-2)-.beta.,D-glucuronopyranosyl, 28-O-.beta.,D-glucopyranosyl hederagenin)
SpectraBase Compound ID IeG52ITUXxg
InChI InChI=1S/C48H76O20/c1-43(2)13-15-48(42(62)68-40-35(59)31(55)29(53)24(19-50)64-40)16-14-46(5)21(22(48)17-43)7-8-26-44(3)11-10-27(45(4,20-51)25(44)9-12-47(26,46)6)65-41-37(33(57)32(56)36(66-41)38(60)61)67-39-34(58)30(54)28(52)23(18-49)63-39/h7,22-37,39-41,49-59H,8-20H2,1-6H3,(H,60,61)/t22?,23-,24+,25?,26?,27+,28+,29+,30+,31-,32-,33+,34-,35+,36+,37-,39+,40-,41-,44+,45+,46-,47-,48+/m1/s1
InChIKey KVCOJLFXXKAKKU-QJUVZHMMSA-N
Mol Weight 973.1 g/mol
Molecular Formula C48H76O20
Exact Mass 972.492995 g/mol
Enantiomer InChIKey KVCOJLFXXKAKKU-NTFQGZPBSA-N
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Source of Spectrum E1-41-79-4

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