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4-O-DEMETHYLMANASSANTIN_B;(7R,7'''R,8R,8'''R)-(7'S*,7''S*,8'R*,8''R*)-4,7,7'''-TRIHYDROXY-3,3',3''-TRIMETHOXY-3''',4'''-METHYLENDIOXY-7',7''-EPOXY-

View entire compound with spectra: 1 NMR

4-O-DEMETHYLMANASSANTIN_B;(7R,7'''R,8R,8'''R)-(7'S*,7''S*,8'R*,8''R*)-4,7,7'''-TRIHYDROXY-3,3',3''-TRIMETHOXY-3''',4'''-METHYLENDIOXY-7',7''-EPOXY-
SpectraBase Compound ID 8Bgm67DS4Mr
InChI InChI=1S/C40H46O11/c1-21-22(2)40(28-11-15-32(35(19-28)46-7)50-24(4)38(43)26-9-13-30-36(17-26)48-20-47-30)51-39(21)27-10-14-31(34(18-27)45-6)49-23(3)37(42)25-8-12-29(41)33(16-25)44-5/h8-19,21-24,37-43H,20H2,1-7H3/t21-,22-,23+,24+,37+,38+,39+,40+/m0/s1
InChIKey WQSGIPAMJXWYGZ-UFHGRMJDSA-N
Mol Weight 702.8 g/mol
Molecular Formula C40H46O11
Exact Mass 702.304012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AesqEIMhMuT
Name 4-O-DEMETHYLMANASSANTIN_B;(7R,7'''R,8R,8'''R)-(7'S*,7''S*,8'R*,8''R*)-4,7,7'''-TRIHYDROXY-3,3',3''-TRIMETHOXY-3''',4'''-METHYLENDIOXY-7',7''-EPOXY-
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46O11
InChI InChI=1S/C40H46O11/c1-21-22(2)40(28-11-15-32(35(19-28)46-7)50-24(4)38(43)26-9-13-30-36(17-26)48-20-47-30)51-39(21)27-10-14-31(34(18-27)45-6)49-23(3)37(42)25-8-12-29(41)33(16-25)44-5/h8-19,21-24,37-43H,20H2,1-7H3/t21-,22-,23+,24+,37+,38+,39+,40+/m0/s1
InChIKey WQSGIPAMJXWYGZ-UFHGRMJDSA-N
Literature Reference Author T.W.HODGES,C.F.HOSSAIN,Y.P.KIM,Y.D.ZHOU,D.G.NAGLE
Literature Reference Citation J.NAT.PROD.,67,767(2004)
Literature Reference DOI 10.1021/np030514m
Molecular Weight 702.799 g/mol
Solvent CDCl3
Source File Reference UWMZ5740