Molecule ID: 442440

IUPAC Name: 2-hydroxy-1-(2-hydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one

Description: The molecule is a member of the class of dihydrochalcones that is dihydrochalcone substituted by a hydroxy group at position 2', methoxy groups at positions 4 and 4' and a hydroxy group at position alpha- to the ketonic group. It has a role as a plant metabolite. It is a member of dihydrochalcones, a monomethoxybenzene, a member of phenols, a diol and a secondary alpha-hydroxy ketone.

SMILES: COc1ccc(CC(O)C(=O)c2ccc(OC)cc2O)cc1

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

InChI: InChI=1S/C17H18O5/c1-21-12-5-3-11(4-6-12)9-16(19)17(20)14-8-7-13(22-2)10-15(14)18/h3-8,10,16,18-19H,9H2,1-2H3

Molecular Properties:
- Polar Surface Area: 76.0 Ų
- LogP: 3.1