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ZIZYPHOISIDE-E
SpectraBase Compound ID w6z9BEzZhk
InChI InChI=1S/C49H78O18/c1-22(2)16-25-17-47(9,58)40-26-10-11-30-45(7)14-13-31(44(5,6)29(45)12-15-46(30,8)48(26)20-49(40,67-25)60-21-48)64-41-35(56)38(27(52)19-59-41)65-43-36(57)39(32(53)28(18-50)63-43)66-42-34(55)33(54)37(23(3)61-42)62-24(4)51/h16,23,25-43,50,52-58H,10-15,17-21H2,1-9H3/t23-,25+,26?,27-,28+,29?,30?,31?,32+,33-,34+,35+,36+,37-,38-,39-,40?,41-,42-,43-,45-,46+,47-,48-,49-/m0/s1
InChIKey MKPLIDATQPIMFJ-IVKVHCEUSA-N
Mol Weight 955.1 g/mol
Molecular Formula C49H78O18
Exact Mass 954.518816 g/mol
Enantiomer InChIKey MKPLIDATQPIMFJ-CGEIGIGCSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent PYRIDINE-D5
Title Journal or Book Year
Structure Elucidation of Three Triterpenoid Saponins from Alphitonia zizyphoides Using 2D Nmr Techniques Journal of Natural Products 1994

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