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BIFLORATOXIN
SpectraBase Compound ID HgYnbfhwlo
InChI InChI=1S/C48H67NO18/c1-23(2)15-17-49-35-40(65-34(52)18-30(51)27-10-8-7-9-11-27)39(66-43-38(55)37(54)36(53)25(4)62-43)31(22-61-67-26(5)50)64-42(35)63-29-20-46(6)32-13-12-28-19-47(32,41(56)24(28)3)16-14-33(46)48(21-29,44(57)58)45(59)60/h7-11,17,23,25,28-33,35-43,51,53-56H,3,12-16,18-22H2,1-2,4-6H3,(H,57,58)(H,59,60)/b49-17+/t25?,28-,29+,30?,31?,32+,33+,35?,36?,37?,38?,39?,40?,41+,42?,43?,46+,47-/m1/s1
InChIKey CGGSVOPXJGNNCI-HENXXENRSA-N
Mol Weight 946.1 g/mol
Molecular Formula C48H67NO18
Exact Mass 945.435814 g/mol
Enantiomer InChIKey CGGSVOPXJGNNCI-DGTZIMGUSA-N
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Solvent CD3OD
Title Journal or Book Year
Bifloratoxin, a Toxic Aminoglycoside of Carboxyatractyligenin, From Melanthera biflora Australian Journal of Chemistry 1990

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