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DISPARINOL-B;5,7-DIHYDROXY-8-(2'''-HYDROXY-3'''-METHYLBUT-3'''-ENYL)-6-(2''-METHYL-1''-OXOBUTYL)-4-PHENYL-2H-BENZOPYRAN-2-ONE
SpectraBase Compound ID AChkoikBd42
InChI InChI=1S/C25H26O6/c1-5-14(4)22(28)21-23(29)17(11-18(26)13(2)3)25-20(24(21)30)16(12-19(27)31-25)15-9-7-6-8-10-15/h6-10,12,14,18,26,29-30H,2,5,11H2,1,3-4H3
InChIKey ZJEGMYRKQKKGKH-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3u3qocbsNU
Name Disparinol B (5,7-Dihydroxy-8-(2"'-hydroxy-3"'-methylbut-3"'-enyl)-6-(2"-methyl-1"-oxobutyl)-4-phenyl-2H-benzopyran-2-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-5-14(4)22(28)21-23(29)17(11-18(26)13(2)3)25-20(24(21)30)16(12-19(27)31-25)15-9-7-6-8-10-15/h6-10,12,14,18,26,29-30H,2,5,11H2,1,3-4H3
InChIKey ZJEGMYRKQKKGKH-UHFFFAOYSA-N
Molecular Weight 422.477 g/mol
SMILES Oc1c(CC(C(=C)C)O)c2OC(C=C(c2c(c1C(=O)C(CC)C)O)c1ccccc1)=O
SPLASH splash10-0uka-0009000000-6a36ac0d4a18863bb4ec
Source of Spectrum H1-51-74-2
Synonyms Disparinol B (5,7-Dihydroxy-8-(2'''-hydroxy-3'''-methylbut-3'''-enyl)-6-(2''-methyl-1''-oxobutyl)-4-phenyl-2H-benzopyran-2-one) 5,7-Dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(2-methyl-1-oxobutyl)-4-phenyl-1-benzopyran-2-one 5,7-Dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(2-methylbutanoyl)-4-phenylchromen-2-one 5,7-Dihydroxy-8-(2-hydroxy-3-methyl-but-3-enyl)-6-(2-methylbutanoyl)-4-phenyl-chromen-2-one 6-(2-Methylbutanoyl)-8-(3-methyl-2-oxidanyl-but-3-enyl)-5,7-bis(oxidanyl)-4-phenyl-chromen-2-one
Wiley ID 817053