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CYANIDIN-3-O-BETA-D-XYLOPYRANOSYL-(1->2)-[6-O-(4-COUMAROYL)-BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID 9S4utXctqcB
InChI InChI=1S/C41H44O22/c42-18-5-1-16(2-6-18)3-8-29(48)56-14-27-31(50)33(52)36(55)39(61-27)58-15-28-32(51)34(53)38(63-40-35(54)30(49)24(47)13-57-40)41(62-28)60-26-12-20-22(45)10-19(43)11-25(20)59-37(26)17-4-7-21(44)23(46)9-17/h1-12,24,27-28,30-36,38-41,47,49-55H,13-15H2,(H4-,42,43,44,45,46,48)/p+1/t24-,27-,28-,30+,31-,32+,33+,34+,35-,36-,38-,39-,40+,41-/m1/s1
InChIKey AVYXHYMPVRRQIG-AHMSEWCKSA-O
Mol Weight 889.8 g/mol
Molecular Formula C41H45O22
Exact Mass 889.240248 g/mol
Enantiomer InChIKey AVYXHYMPVRRQIG-HPSNCPBLSA-O
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