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VOGELIN-E;5,7,4'-TRIHYDROXY-3'-[(2E)-4''-HYDROXY-3-METHYLBUT-2-ENYL)]-ISOFLAVONE
SpectraBase Compound ID 2cnGl7WMpc3
InChI InChI=1S/C20H18O6/c1-11(9-21)2-3-13-6-12(4-5-16(13)23)15-10-26-18-8-14(22)7-17(24)19(18)20(15)25/h2,4-8,10,21-24H,3,9H2,1H3/b11-2+
InChIKey NEQDXCVCMNDZJU-BIIKFXOESA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUGIiFlg4lB
Name Vogelin E
Alternate Name(s) 3-[3-[(E)-3-methyl-4-oxidanyl-but-2-enyl]-4-oxidanyl-phenyl]-5,7-bis(oxidanyl)chromen-4-one 5,7-Dihydroxy-3-[4-hydroxy-3-[(E)-4-hydroxy-3-methyl-but-2-enyl]phenyl]chromen-4-one 5,7-Dihydroxy-3-[4-hydroxy-3-[(E)-4-hydroxy-3-methyl-but-2-enyl]phenyl]chromone 5,7-Dihydroxy-3-[4-hydroxy-3-[(E)-4-hydroxy-3-methylbut-2-enyl]phenyl]-1-benzopyran-4-one
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Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-11(9-21)2-3-13-6-12(4-5-16(13)23)15-10-26-18-8-14(22)7-17(24)19(18)20(15)25/h2,4-8,10,21-24H,3,9H2,1H3/b11-2+
InChIKey NEQDXCVCMNDZJU-BIIKFXOESA-N
Molecular Weight 354.358 g/mol
SMILES Oc1cc(cc2c1C(C(c1ccc(c(c1)C\C=C\(CO)C)O)=CO2)=O)O
SPLASH splash10-00dr-0109000000-cb83dbf0af9899c3f413
Source of Spectrum G4-65-405-2
Wiley ID 1639356