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XANTHOANGELOL_B;2',4,4'-TRIHYDROXY-3'-[(E)-6-HYDROXY-3,7-DIMETHYL-2,7-OCTADIENYL]-CHALCONE
SpectraBase Compound ID 3rjUve6rO4k
InChI InChI=1S/C25H28O5/c1-16(2)22(27)13-5-17(3)4-11-20-24(29)15-12-21(25(20)30)23(28)14-8-18-6-9-19(26)10-7-18/h4,6-10,12,14-15,22,26-27,29-30H,1,5,11,13H2,2-3H3/b14-8+,17-4+
InChIKey NCHZAFAGBAEJJJ-BAYITLGHSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NLBoGcbztq
Name 2',4,4'-TRIHYDROXY-3'-[6-HYDROXY-3,7-DIMETHYL-2-(E),7-OCTADIENYL]-CHALCONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-16(2)22(27)13-5-17(3)4-11-20-24(29)15-12-21(25(20)30)23(28)14-8-18-6-9-19(26)10-7-18/h4,6-10,12,14-15,22,26-27,29-30H,1,5,11,13H2,2-3H3/b14-8+,17-4+
InChIKey NCHZAFAGBAEJJJ-BAYITLGHSA-N
Literature Reference Author L.JAYASINGHE,B.A.I.S.BALASOORIYA,W.C.PADMINI,N.HARA,Y.FUJIMO TO
Literature Reference Citation PHYTOCHEM.,65,1287(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.03.033
Molecular Weight 408.494 g/mol
Solvent CDCl3
Source File Reference UWVN31338