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GNETIN-J-OCTAACETATE;3''-HYDROXYGNETIN-E-OCTAACETATE
SpectraBase Compound ID 1hsz3iknuh5
InChI InChI=1S/C58H48O18/c1-29(59)67-43-16-11-37(12-17-43)9-10-38-21-49(73-35(7)65)55-50(22-38)75-57(39-13-18-44(19-14-39)68-30(2)60)54(55)42-26-51(74-36(8)66)56-52(27-42)76-58(40-15-20-47(71-33(5)63)48(25-40)72-34(6)64)53(56)41-23-45(69-31(3)61)28-46(24-41)70-32(4)62/h9-28,53-54,57-58H,1-8H3/b10-9+/t53-,54-,57+,58+/m1/s1
InChIKey HIZNWXLSJLIANW-RGIDETMGSA-N
Mol Weight 1033.0 g/mol
Molecular Formula C58H48O18
Exact Mass 1032.284065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KInnIhLQrEc
Name GNETIN-J-OCTAACETATE;3''-HYDROXYGNETIN-E-OCTAACETATE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H48O18
InChI InChI=1S/C58H48O18/c1-29(59)67-43-16-11-37(12-17-43)9-10-38-21-49(73-35(7)65)55-50(22-38)75-57(39-13-18-44(19-14-39)68-30(2)60)54(55)42-26-51(74-36(8)66)56-52(27-42)76-58(40-15-20-47(71-33(5)63)48(25-40)72-34(6)64)53(56)41-23-45(69-31(3)61)28-46(24-41)70-32(4)62/h9-28,53-54,57-58H,1-8H3/b10-9+/t53-,54-,57+,58+/m1/s1
InChIKey HIZNWXLSJLIANW-RGIDETMGSA-N
Literature Reference Author N.BORALLE,H.E.GOTTLIEB,O.R.GOTTLIEB,K.KUBITZKI,L.M.X.LOPES,M .YOSHIDA,M.C.M.YOUNG
Literature Reference Citation PHYTOCHEM.,34,1403(1993)
Literature Reference DOI 10.1016/0031-9422(91)80038-3
Molecular Weight 1033.008 g/mol
Solvent CDCl3
Source File Reference UWLU20686