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POLYSPERLIGNAN_E

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POLYSPERLIGNAN_E
SpectraBase Compound ID FlveUw2lqd1
InChI InChI=1S/C37H40O10/c1-9-20(2)37(39)47-32-22(4)21(3)31(46-28(38)16-15-23-13-11-10-12-14-23)24-17-26(40-5)33(41-6)35(42-7)29(24)30-25(32)18-27-34(36(30)43-8)45-19-44-27/h9-18,21-22,31-32H,19H2,1-8H3/b16-15+,20-9-/t21-,22+,31+,32+/m0/s1
InChIKey DHKOFLWROPIHJS-HWDZMEBBSA-N
Mol Weight 644.7 g/mol
Molecular Formula C37H40O10
Exact Mass 644.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74ake0vR1tA
Name POLYSPERLIGNAN_E
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H40O10
InChI InChI=1S/C37H40O10/c1-9-20(2)37(39)47-32-22(4)21(3)31(46-28(38)16-15-23-13-11-10-12-14-23)24-17-26(40-5)33(41-6)35(42-7)29(24)30-25(32)18-27-34(36(30)43-8)45-19-44-27/h9-18,21-22,31-32H,19H2,1-8H3/b16-15+,20-9-/t21-,22+,31+,32+/m0/s1
InChIKey DHKOFLWROPIHJS-HWDZMEBBSA-N
Literature Reference Author K.DONG,J.X.PUMH.Y.ZHANG,X.DU,X.N.LI,J.ZOU,J.H.YANG,W.ZHAO,X. C.TANG,H.D.SUN
Literature Reference Citation J.NAT.PROD.,75,249(2012)
Literature Reference DOI 10.1021/np200937h
Molecular Weight 644.719 g/mol
Sample ID 40059
Solvent CDCl3