Molecule ID: 5281698

IUPAC Name: 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-8-methoxychromen-4-one

Description: The molecule is a 7-hydroxyflavonol that is kaempferol substituted by a methoxy group at position 8. It has a role as a plant metabolite. It is a tetrahydroxyflavone, a 7-hydroxyflavonol and a monomethoxyflavone. It derives from a kaempferol.

SMILES: COc1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12

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

InChI: InChI=1S/C16H12O7/c1-22-15-10(19)6-9(18)11-12(20)13(21)14(23-16(11)15)7-2-4-8(17)5-3-7/h2-6,17-19,21H,1H3

Molecular Properties:
- Polar Surface Area: 116.0 Ų
- LogP: 2.5