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

View entire compound with spectra: 1 NMR

SARMENTOSUMIND;(2-S)-5,7-DIHYDROXY-6-(2'''-HYDROXY-5'''-(2'''''-HYDROXY-5'''''-(2''''''-HYDROXYBENZYL)-BENZYL)-BENZYL)-8-(2''-HYDROXY-5''-(2''''-HYDROXY
SpectraBase Compound ID 7I68v2LH4gq
InChI InChI=1S/C50H42O9/c51-40-12-6-4-10-33(40)20-29-14-17-42(53)35(22-29)23-31-16-19-43(54)36(25-31)26-38-48(57)39(27-37-24-30(15-18-44(37)55)21-34-11-5-7-13-41(34)52)50-47(49(38)58)45(56)28-46(59-50)32-8-2-1-3-9-32/h1-19,22,24-25,46,51-55,57-58H,20-21,23,26-28H2/t46-/m0/s1
InChIKey ITTFKAGXWJOGGC-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 65mQEa5KDcJ
Name SARMENTOSUMIND;(2-S)-5,7-DIHYDROXY-6-(2'''-HYDROXY-5'''-(2'''''-HYDROXY-5'''''-(2''''''-HYDROXYBENZYL)-BENZYL)-BENZYL)-8-(2''-HYDROXY-5''-(2''''-HYDROXY
Compound Number 4
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(22-29)23-31-16-19-43(54)36(25-31)26-38-48(57)39(27-37-24-30(15-18-44(37)55)21-34-11-5-7-13-41(34)52)50-47(49(38)58)45(56)28-46(59-50)32-8-2-1-3-9-32/h1-19,22,24-25,46,51-55,57-58H,20-21,23,26-28H2/t46-/m0/s1
InChIKey ITTFKAGXWJOGGC-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 39424
Solvent CDCl3