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BOESENBERGIN-A;(+/-)-(E)-1-[7'-HYDROXY-5'-METHOXY-2'-METHYL-2'-(4''-METHYL-PENT-3''-ENYL)-2'H-1-BENZOPYRAN-8'-YL]-3-PHENYL-PROP-2-EN-1-ONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

BOESENBERGIN-A;(+/-)-(E)-1-[7'-HYDROXY-5'-METHOXY-2'-METHYL-2'-(4''-METHYL-PENT-3''-ENYL)-2'H-1-BENZOPYRAN-8'-YL]-3-PHENYL-PROP-2-EN-1-ONE
SpectraBase Compound ID 4w1SykS0A7J
InChI InChI=1S/C26H28O4/c1-18(2)9-8-15-26(3)16-14-20-23(29-4)17-22(28)24(25(20)30-26)21(27)13-12-19-10-6-5-7-11-19/h5-7,9-14,16-17,28H,8,15H2,1-4H3/b13-12+
InChIKey CTWSWRSNFKNYMF-OUKQBFOZSA-N
Mol Weight 404.51 g/mol
Molecular Formula C26H28O4
Exact Mass 404.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Edity9wyMXH
Name (E)-1-[5-methoxy-2-methyl-2-(4-methylpent-3-enyl)-7-oxidanyl-chromen-8-yl]-3-phenyl-prop-2-en-1-one
Alternate Name(s) (E)-1-[7-hydroxy-5-methoxy-2-methyl-2-(4-methylpent-3-enyl)-1-benzopyran-8-yl]-3-phenyl-2-propen-1-one (E)-1-[7-hydroxy-5-methoxy-2-methyl-2-(4-methylpent-3-enyl)chromen-8-yl]-3-phenyl-prop-2-en-1-one Boesenbergin A
CAS Registry Number 81943-62-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O4
InChI InChI=1S/C26H28O4/c1-18(2)9-8-15-26(3)16-14-20-23(29-4)17-22(28)24(25(20)30-26)21(27)13-12-19-10-6-5-7-11-19/h5-7,9-14,16-17,28H,8,15H2,1-4H3/b13-12+
InChIKey CTWSWRSNFKNYMF-OUKQBFOZSA-N
Molecular Weight 404.506 g/mol
SMILES Oc1c(c2c(C=CC(O2)(CCC=C(C)C)C)c(c1)OC)C(\C=C\c1ccccc1)=O
SPLASH splash10-06di-9077300000-2cc6a4522c55168d11b0
Source of Spectrum B-35-356-0
Wiley ID 1371533