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VIARUMACID_B;1-BETA,4-BETA-DIHYDROXY-3-BETA-CARBOXYACETOXY-5-ALPHA-{[3-[4-[1-BETA-(6-O-(5-(E)-CAFFEOYLQUINIC_ACID)-BETA-D-GLUCOPYRANOSYL)-OXY]-
SpectraBase Compound ID GNgjotn08am
InChI InChI=1S/C41H46O25/c42-19-5-1-17(9-20(19)43)3-7-29(48)62-24-15-41(60,12-22(45)32(24)51)39(58)61-16-27-34(53)35(54)36(55)37(66-27)65-23-6-2-18(10-21(23)44)4-8-30(49)63-25-13-40(59,38(56)57)14-26(33(25)52)64-31(50)11-28(46)47/h1-10,22,24-27,32-37,42-45,51-55,59-60H,11-16H2,(H,46,47)(H,56,57)/b7-3+,8-4+/t22-,24+,25-,26-,27-,32-,33+,34-,35+,36-,37-,40-,41+/m1/s1
InChIKey DHPNADKGHOWBIT-GXTUTOQJSA-N
Mol Weight 938.8 g/mol
Molecular Formula C41H46O25
Exact Mass 938.232817 g/mol
Enantiomer InChIKey DHPNADKGHOWBIT-WXBWUHSUSA-N
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