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SARMENTOSUMINC;5,7-DIHYDROXY-6-(2'''-HYDROXY-5'''-(2''''-HYDROXY-5''''-(2'''''-HYDROXY-5'''''-(2''''''-HYDROXYBENZYL)-BENZYL)-BENZYL)-BENZYL)-8-

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SARMENTOSUMINC;5,7-DIHYDROXY-6-(2'''-HYDROXY-5'''-(2''''-HYDROXY-5''''-(2'''''-HYDROXY-5'''''-(2''''''-HYDROXYBENZYL)-BENZYL)-BENZYL)-BENZYL)-8-
SpectraBase Compound ID 85yFYYQ9QNu
InChI InChI=1S/C50H42O9/c51-40-12-6-4-10-33(40)20-29-14-17-42(53)35(21-29)22-30-15-18-43(54)36(23-30)24-31-16-19-44(55)37(25-31)27-38-48(57)39(26-34-11-5-7-13-41(34)52)50-47(49(38)58)45(56)28-46(59-50)32-8-2-1-3-9-32/h1-19,21,23,25,46,51-55,57-58H,20,22,24,26-28H2/t46-/m0/s1
InChIKey RSPYQSBMMWSZTA-DXQCBLCSSA-N
Mol Weight 786.9 g/mol
Molecular Formula C50H42O9
Exact Mass 786.282883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 676vvWhXsj5
Name SARMENTOSUMINC;5,7-DIHYDROXY-6-(2'''-HYDROXY-5'''-(2''''-HYDROXY-5''''-(2'''''-HYDROXY-5'''''-(2''''''-HYDROXYBENZYL)-BENZYL)-BENZYL)-BENZYL)-8-
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H42O9
InChI InChI=1S/C50H42O9/c51-40-12-6-4-10-33(40)20-29-14-17-42(53)35(21-29)22-30-15-18-43(54)36(23-30)24-31-16-19-44(55)37(25-31)27-38-48(57)39(26-34-11-5-7-13-41(34)52)50-47(49(38)58)45(56)28-46(59-50)32-8-2-1-3-9-32/h1-19,21,23,25,46,51-55,57-58H,20,22,24,26-28H2/t46-/m0/s1
InChIKey RSPYQSBMMWSZTA-DXQCBLCSSA-N
Literature Reference Author L.PAN,S.MATTHEW,D.D.LANTVIT,X.ZHANG,T.N.NINH,H.CHAI,E.J.C.DE BLANCO,D.D.SOEJARTO,
Literature Reference Citation J.NAT.PROD.,74,2193(2011)
Literature Reference DOI 10.1021/np200557e
Molecular Weight 786.878 g/mol
Sample ID 39423
Solvent CDCl3