Bio-Rad Laboratories, Inc. SpectraBase; SpectraBase Compound ID=LfX4OPVfb SpectraBase Spectrum ID=DoPftRTSzGm
http://spectrabase.com/spectrum/DoPftRTSzGm (accessed Aug 16, 2018).

DESGLUCOLANATIGONIN_II
SpectraBase Compound ID LfX4OPVfb
InChI InChI=1S/C50H82O22/c1-20-7-12-50(64-18-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(62)37(59)41(31(17-53)68-45)69-47-43(71-46-39(61)36(58)34(56)29(15-51)66-46)42(35(57)30(16-52)67-47)70-44-38(60)33(55)27(54)19-63-44/h20-47,51-62H,5-19H2,1-4H3/t20-,21+,22+,23+,24?,25?,26?,27-,28?,29+,30+,31-,32?,33+,34-,35+,36-,37-,38-,39+,40-,41+,42-,43+,44+,45-,46-,47-,48+,49+,50-/m1/s1
InChIKey BJNQXJIQCPPOHN-OZPUGUJJSA-N
Mol Weight 1035.2 g/mol
Molecular Formula C50H82O22
Exact Mass 1034.529775 g/mol

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SpectraBase Spectrum ID DoPftRTSzGm
SpectraBase Batch ID 7ynBE5kfH9W
Name DESGLUCOLANATIGONIN_II
Compound Number 3
Copyright Copyright © 2016 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H82O22
InChI InChI=1S/C50H82O22/c1-20-7-12-50(64-18-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(62)37(59)41(31(17-53)68-45)69-47-43(71-46-39(61)36(58)34(56)29(15-51)66-46)42(35(57)30(16-52)67-47)70-44-38(60)33(55)27(54)19-63-44/h20-47,51-62H,5-19H2,1-4H3/t20-,21+,22+,23+,24?,25?,26?,27-,28?,29+,30+,31-,32?,33+,34-,35+,36-,37-,38-,39+,40-,41+,42-,43+,44+,45-,46-,47-,48+,49+,50-/m1/s1
InChIKey BJNQXJIQCPPOHN-OZPUGUJJSA-N
Literature Reference Author T.INOUE,Y.MIMAKI,Y.SASHIDA,T.NIKAIDO,T.OHMOTO
Literature Reference Citation PHYTOCHEM.,39,1103(1995)
Literature Reference DOI 10.1016/0031-9422(95)00117-P
Mol.Weight 1035.188 g/mol
Solvent C5D5N
Source File Reference UWMZ9063