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IRIDOID-DIMER-OF-ASPERULOSIDE-AND-ASPERULOSIDIC-ACID
SpectraBase Compound ID 2Us2XiMaFpS
InChI InChI=1S/C36H44O22/c1-11(38)49-6-13-3-17(40)23-15(8-52-33(21(13)23)57-35-29(45)27(43)25(41)19(5-37)55-35)31(47)51-10-20-26(42)28(44)30(46)36(56-20)58-34-22-14(7-50-12(2)39)4-18-24(22)16(9-53-34)32(48)54-18/h3-4,8-9,17-30,33-37,40-46H,5-7,10H2,1-2H3/t17-,18+,19-,20-,21+,22-,23-,24+,25-,26-,27+,28+,29-,30-,33-,34+,35+,36+/m0/s1
InChIKey BFJACKWATUXTOO-GFVJKJLASA-N
Mol Weight 828.7 g/mol
Molecular Formula C36H44O22
Exact Mass 828.232423 g/mol
Enantiomer InChIKey BFJACKWATUXTOO-OIYWHAQSSA-N
Unknown Identification

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