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#13;12-O-ACETYL-PERGULARIN-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-CYMAROPYRANOSYL-(1->

Compound with spectra: 1 NMR

#13;12-O-ACETYL-PERGULARIN-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-CYMAROPYRANOSYL-(1->
SpectraBase Compound ID 95O39Uz7fXT
InChI InChI=1S/C64H104O24/c1-30-55(68)43(71-11)25-51(76-30)84-56-31(2)77-49(24-42(56)67)85-57-33(4)79-52(27-45(57)73-13)87-59-35(6)81-54(29-47(59)75-15)88-60-34(5)80-53(28-46(60)74-14)86-58-32(3)78-50(26-44(58)72-12)83-39-18-19-61(9)38(22-39)16-17-40-41(61)23-48(82-37(8)66)62(10)63(69,36(7)65)20-21-64(40,62)70/h16,30-35,39-60,67-70H,17-29H2,1-15H3/t30-,31+,32-,33+,34-,35+,39+,40-,41+,42-,43+,44+,45-,46+,47-,48-,49-,50+,51-,52-,53-,54+,55-,56+,57+,58-,59+,60-,61+,62-,63-,64+/m1/s1
InChIKey NGBYNFODEMEVDO-GHJWMJONSA-N
Mol Weight 1257.5 g/mol
Molecular Formula C64H104O24
Exact Mass 1256.691754 g/mol
Enantiomer InChIKey NGBYNFODEMEVDO-KENCFHQMSA-N

View Spectrum of #13;12-O-ACETYL-PERGULARIN-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-DIGITOXYPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-CYMAROPYRANOSYL-(1->

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Steroidal Glycosides from the Root of Metaplexis japonica M. Part II. Chemical and Pharmaceutical Bulletin 1998

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