6-(3-methylbutanoyl)-8-(3-methyl-2-oxidanyl-but-3-enyl)-5,7-bis(oxidanyl)-4-phenyl-chromen-2-one

Systemtic Name: 6-(3-methylbutanoyl)-8-(3-methyl-2-oxidanyl-but-3-enyl)-5,7-bis(oxidanyl)-4-phenyl-chromen-2-one Openeye Name: 5,7-dihydroxy-8-(2-hydroxy-3-methyl-but-3-enyl)-6-(3-methylbutanoyl)-4-phenyl-chromen-2-one CAS Name: 5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(3-methyl-1-oxobutyl)-4-phenyl-1-benzopyran-2-one IUPAC Name: 5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(3-methylbutanoyl)-4-phenylchromen-2-one Traditional Name: 5,7-dihydroxy-8-(2-hydroxy-3-methyl-but-3-enyl)-6-isovaleryl-4-phenyl-coumarin Formula: C25H26O6 MolecularWeight: 422.47034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=C(C2=C(C(=C1O)CC(C(=C)C)O)OC(=O)C=C2C3=CC=CC=C3)O

Isomeric SMILES

CC(C)CC(=O)C1=C(C2=C(C(=C1O)CC(C(=C)C)O)OC(=O)C=C2C3=CC=CC=C3)O

InChI

InChI=1S/C25H26O6/c1-13(2)10-19(27)22-23(29)17(11-18(26)14(3)4)25-21(24(22)30)16(12-20(28)31-25)15-8-6-5-7-9-15/h5-9,12-13,18,26,29-30H,3,10-11H2,1-2,4H3