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19-O-ISOVALEROYL-14,15,16-TRIACETYL-14,15,16,19-TETRAHYDROXY-ENT-MANOYLOXIDE
SpectraBase Compound ID JLHTMQdqlKb
InChI InChI=1S/C31H50O9/c1-20(2)16-27(35)38-18-28(6)12-9-13-29(7)24(28)10-14-30(8)25(29)11-15-31(40-30,19-37-22(4)33)26(39-23(5)34)17-36-21(3)32/h20,24-26H,9-19H2,1-8H3/t24-,25+,26+,28+,29-,30+,31+/m1/s1
InChIKey XOMCSVOFUKYCPX-DFWJHAOZSA-N
Mol Weight 566.7 g/mol
Molecular Formula C31H50O9
Exact Mass 566.345483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHoPF48XRmz
Name 19-O-ISOVALEROYL-14,15,16-TRIACETYL-14,15,16,19-TETRAHYDROXY-ENT-MANOYLOXIDE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H50O9
InChI InChI=1S/C31H50O9/c1-20(2)16-27(35)38-18-28(6)12-9-13-29(7)24(28)10-14-30(8)25(29)11-15-31(40-30,19-37-22(4)33)26(39-23(5)34)17-36-21(3)32/h20,24-26H,9-19H2,1-8H3/t24-,25+,26+,28+,29-,30+,31+/m1/s1
InChIKey XOMCSVOFUKYCPX-DFWJHAOZSA-N
Literature Reference Author A.L.PEREZ-CASTORENA,M.MARTINEZ-VAZQUEZ,A.R.D.VIVAR
Literature Reference Citation PHYTOCHEM.,46,729(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00235-5
Molecular Weight 566.733 g/mol
Sample ID 44930
Solvent CDCl3