2-(3-methoxy-4-oxidanyl-phenyl)-6-(3-methylbut-2-enyl)-3,5,7-tris(oxidanyl)chromen-4-one

Systemtic Name: 2-(3-methoxy-4-oxidanyl-phenyl)-6-(3-methylbut-2-enyl)-3,5,7-tris(oxidanyl)chromen-4-one Openeye Name: 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-6-(3-methylbut-2-enyl)chromen-4-one CAS Name: 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methylbut-2-enyl)-1-benzopyran-4-one IUPAC Name: 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one Traditional Name: 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-6-(3-methylbut-2-enyl)chromone Formula: C21H20O7 MolecularWeight: 384.3793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)OC)O)O)C

Isomeric SMILES

CC(=CCC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)OC)O)O)C

InChI

InChI=1S/C21H20O7/c1-10(2)4-6-12-14(23)9-16-17(18(12)24)19(25)20(26)21(28-16)11-5-7-13(22)15(8-11)27-3/h4-5,7-9,22-24,26H,6H2,1-3H3