Molecule ID: 23259413

IUPAC Name: 5,7-dihydroxy-3-[(4-methoxyphenyl)methyl]-6,8-dimethylchromen-4-one

Description: The molecule is a homoisoflavonoid that is 4H-1-benzopyran-4-one substituted by hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a (4-methoxyphenyl)methyl group at position 3 respectively. It has a role as a plant metabolite. It is a homoisoflavonoid, a member of resorcinols and a monomethoxybenzene.

SMILES: COc1ccc(Cc2coc3c(C)c(O)c(C)c(O)c3c2=O)cc1

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

InChI: InChI=1S/C19H18O5/c1-10-16(20)11(2)19-15(17(10)21)18(22)13(9-24-19)8-12-4-6-14(23-3)7-5-12/h4-7,9,20-21H,8H2,1-3H3

Molecular Properties:
- Polar Surface Area: 76.0 Ų
- LogP: 4.0