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TRIGOHOWNIN_E
SpectraBase Compound ID 9Rpx19Pz0K1
InChI InChI=1S/C40H46O13/c1-20(2)39-30(49-33(43)25-15-11-9-12-16-25)22(4)40-27-19-21(3)29(47-23(5)41)38(27,46)35(50-34(44)26-17-13-10-14-18-26)36(7,45)31(48-24(6)42)28(40)32(39)51-37(8,52-39)53-40/h9-18,21-22,27-32,35,45-46H,1,19H2,2-8H3/t21-,22+,27+,28-,29-,30-,31-,32+,35+,36+,37+,38+,39-,40-/m0/s1
InChIKey YRHRFRAGMYDVMA-PCZCKZCOSA-N
Mol Weight 734.8 g/mol
Molecular Formula C40H46O13
Exact Mass 734.293842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FAVEkMZw2Ik
Name TRIGOHOWNIN_E
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46O13
InChI InChI=1S/C40H46O13/c1-20(2)39-30(49-33(43)25-15-11-9-12-16-25)22(4)40-27-19-21(3)29(47-23(5)41)38(27,46)35(50-34(44)26-17-13-10-14-18-26)36(7,45)31(48-24(6)42)28(40)32(39)51-37(8,52-39)53-40/h9-18,21-22,27-32,35,45-46H,1,19H2,2-8H3/t21-,22+,27+,28-,29-,30-,31-,32+,35+,36+,37+,38+,39-,40-/m0/s1
InChIKey YRHRFRAGMYDVMA-PCZCKZCOSA-N
Literature Reference Author S.H.DONG,C.R.ZHANG,C.H.XU,J.DING,J.M.YUE
Literature Reference Citation J.NAT.PROD.,74,1255(2011)
Literature Reference DOI 10.1021/np200231u
Molecular Weight 734.797 g/mol
Sample ID 38325
Solvent CDCl3