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MILLEWANIN_H
SpectraBase Compound ID Dbp0KKrsy9z
InChI InChI=1S/C25H26O7/c1-12(2)5-7-15-22(29)16(10-19(27)13(3)4)25-21(23(15)30)24(31)17(11-32-25)14-6-8-18(26)20(28)9-14/h5-6,8-9,11,19,26-30H,3,7,10H2,1-2,4H3
InChIKey RZHIZFURFGRHHQ-UHFFFAOYSA-N
Mol Weight 438.48 g/mol
Molecular Formula C25H26O7
Exact Mass 438.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIykhM5Q7XX
Name 3-(3',4'-Dihydroxyphenyl)-8-[2"-hydroxy-3"-methyl-3"-butenyl]-6-(3"'-methyl-2"'-butenyl)-5,7-dihydroxybenzopyran-4(4H)-one
Alternate Name(s) Millewanin H 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(3-methylbut-2-enyl)-1-benzopyran-4-one 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(3-methylbut-2-enyl)chromen-4-one 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-(2-hydroxy-3-methyl-but-3-enyl)-6-(3-methylbut-2-enyl)chromen-4-one 3-[3,4-bis(oxidanyl)phenyl]-6-(3-methylbut-2-enyl)-8-(3-methyl-2-oxidanyl-but-3-enyl)-5,7-bis(oxidanyl)chromen-4-one
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Formula C25H26O7
InChI InChI=1S/C25H26O7/c1-12(2)5-7-15-22(29)16(10-19(27)13(3)4)25-21(23(15)30)24(31)17(11-32-25)14-6-8-18(26)20(28)9-14/h5-6,8-9,11,19,26-30H,3,7,10H2,1-2,4H3
InChIKey RZHIZFURFGRHHQ-UHFFFAOYSA-N
Molecular Weight 438.476 g/mol
SMILES OC(Cc1c2c(C(C(c3ccc(c(c3)O)O)=CO2)=O)c(c(c1O)CC=C(C)C)O)C(=C)C
SPLASH splash10-014i-0098100000-29f29cc53b0471ed5133
Source of Spectrum G4-69-140-2
Wiley ID 1694620