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IKEMAGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXOPYRANOSYL-(1->4)-BETA-D-CANAROPYRANOSYL-(1->4)-BETA-D-CYMA
SpectraBase Compound ID AGAG6xq1fH0
InChI InChI=1S/C69H104O26/c1-33(71)42-21-24-69(79)67(42,8)50(90-51(74)18-17-39-15-13-12-14-16-39)31-49-66(7)22-20-41(25-40(66)19-23-68(49,69)78)88-54-28-45(80-9)63(36(4)85-54)94-56-29-46(81-10)62(37(5)86-56)93-53-27-44(73)60(34(2)84-53)91-52-26-43(72)61(35(3)83-52)92-55-30-47(82-11)64(38(6)87-55)95-65-59(77)58(76)57(75)48(32-70)89-65/h12-19,34-38,41-50,52-65,70,72-73,75-79H,20-32H2,1-11H3/b18-17+/t34-,35-,36+,37-,38+,41-,42-,43+,44-,45-,46+,47-,48-,49+,50+,52+,53+,54-,55-,56+,57-,58+,59-,60-,61-,62-,63+,64+,65+,66-,67-,68-,69+/m0/s1
InChIKey LHVZRCYMCSSAMT-XFGXPGFOSA-N
Mol Weight 1349.6 g/mol
Molecular Formula C69H104O26
Exact Mass 1348.681583 g/mol
Enantiomer InChIKey LHVZRCYMCSSAMT-NQPCMEKDSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Pregnane Glycosides from the Roots of Asclepias tuberosd. Chemical and Pharmaceutical Bulletin 2000

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