Molecule ID: 5281697

IUPAC Name: 5,6,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one

Description: The molecule is flavone substituted with hydroxy groups at C-4', -5, -6 and -7. It has a role as a metabolite. It derives from an apigenin. It is a conjugate acid of a scutellarein(1-).

SMILES: O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(O)c(O)c12

SELFIES: [O][=C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][C][=C][C][Branch1][C][O][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring2][Ring1][Ring2][Ring1][=Branch2]

InChI: InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)11-5-9(17)13-12(21-11)6-10(18)14(19)15(13)20/h1-6,16,18-20H

Molecular Properties:
- Polar Surface Area: 107.0 Ų
- LogP: 1.4