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(S,E)-2-(3,4-dihydroxyphenyl)-6-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxychroman-4-one
SpectraBase Compound ID Cjb0aztYedg
InChI InChI=1S/C25H28O6/c1-14(2)5-4-6-15(3)7-9-17-19(27)12-23-24(25(17)30)21(29)13-22(31-23)16-8-10-18(26)20(28)11-16/h5,7-8,10-12,22,26-28,30H,4,6,9,13H2,1-3H3/b15-7+/t22-/m0/s1
InChIKey XCYSQFHYFNWYFP-CEMXSPGASA-N
Mol Weight 424.49 g/mol
Molecular Formula C25H28O6
Exact Mass 424.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaW8lE9BNRz
Name (S,E)-2-(3,4-dihydroxyphenyl)-6-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxychroman-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28O6
InChI InChI=1S/C25H28O6/c1-14(2)5-4-6-15(3)7-9-17-19(27)12-23-24(25(17)30)21(29)13-22(31-23)16-8-10-18(26)20(28)11-16/h5,7-8,10-12,22,26-28,30H,4,6,9,13H2,1-3H3/b15-7+/t22-/m0/s1
InChIKey XCYSQFHYFNWYFP-CEMXSPGASA-N
Molecular Weight 424.493 g/mol
SMILES Oc1c(ccc([C@@]2(CC(c3c(cc(c(c3O)C\C=C\(CCC=C(C)C)C)O)O2)=O)[H])c1)O
SPLASH splash10-0gb9-6965100000-5eaccc4e2ff5c9cbb7f4
Source of Spectrum Jung Keun Cho, et al. Bioorganic & Medicinal Chemistry, V.21, 2013, P.3051-3057
Wiley ID 1816883