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REL-(7S,8S,1'R,2'S)-2'-HYDROXY-3,4-METHYLENEDIOXY-5,3',5'-TRIMETHOXY-DELTA(1,3,5,3',8')-8.1',7.O.2'-NEOLIGNAN
SpectraBase Compound ID 3yuN5asAz9z
InChI InChI=1S/C22H28O7/c1-6-7-21-11-15(24-3)10-18(26-5)22(21,23)29-19(13(21)2)14-8-16(25-4)20-17(9-14)27-12-28-20/h6,8-10,13,15,19,23H,1,7,11-12H2,2-5H3/t13-,15+,19-,21-,22-/m1/s1
InChIKey FRAMVJAUACUCLB-IIYBBYTNSA-N
Mol Weight 404.46 g/mol
Molecular Formula C22H28O7
Exact Mass 404.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D9ptx6Ur5Ou
Name REL-(7S,8S,1'R,2'S)-2'-HYDROXY-3,4-METHYLENEDIOXY-5,3',5'-TRIMETHOXY-DELTA(1,3,5,3',8')-8.1',7.O.2'-NEOLIGNAN
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O7
InChI InChI=1S/C22H28O7/c1-6-7-21-11-15(24-3)10-18(26-5)22(21,23)29-19(13(21)2)14-8-16(25-4)20-17(9-14)27-12-28-20/h6,8-10,13,15,19,23H,1,7,11-12H2,2-5H3/t13-,15+,19-,21-,22-/m1/s1
InChIKey FRAMVJAUACUCLB-IIYBBYTNSA-N
Literature Reference Author M.FUNASAKI,A.L.L.LORDELLO,A.M.VIANA,C.SANTA-CATARINA,E.I.S.F LOH,M.YOSHIDA
Literature Reference Citation J.BRAZ.CHEM.SOC.,20,853(2009)
Literature Reference DOI 10.1590/s0103-50532009000500008
Molecular Weight 404.460 g/mol
Source File Reference UWBT6173