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Digoxigenin digitoxosido-glucomethyloside
SpectraBase Compound ID 9KQf4GXyToU
InChI InChI=1S/C35H54O12/c1-16-28(39)29(40)30(41)32(45-16)47-31-17(2)44-27(14-24(31)36)46-20-7-9-33(3)19(12-20)5-6-22-23(33)13-25(37)34(4)21(8-10-35(22,34)42)18-11-26(38)43-15-18/h11,16-17,19-25,27-32,36-37,39-42H,5-10,12-15H2,1-4H3/t16?,17-,19?,20?,21?,22?,23?,24+,25?,27-,28?,29?,30?,31+,32?,33?,34?,35?/m1/s1
InChIKey FSKRCOPPXZHDSV-QXHAFGAJSA-N
Mol Weight 666.8 g/mol
Molecular Formula C35H54O12
Exact Mass 666.361527 g/mol
Enantiomer InChIKey FSKRCOPPXZHDSV-YHVZPDFCSA-N
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Solvent Mixture

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