Molecule ID: 25202158

IUPAC Name: 7-hydroxy-6-methoxy-3-(2,4,5-trimethoxyphenyl)chromen-4-one

Description: The molecule is a member of the class of 7-hydroxyisoflavones that is isoflavone having four methoxy substituents at the 2'-, 4'-, 5'- and 6-positions and a hydroxy group at position 7. It is a member of 7-hydroxyisoflavones and a member of 4'-methoxyisoflavones. It is a conjugate acid of a dalnigrein(1-).

SMILES: COc1cc2c(=O)c(-c3cc(OC)c(OC)cc3OC)coc2cc1O

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

InChI: InChI=1S/C19H18O7/c1-22-14-8-18(25-4)17(24-3)5-10(14)12-9-26-15-7-13(20)16(23-2)6-11(15)19(12)21/h5-9,20H,1-4H3

Molecular Properties:
- Polar Surface Area: 83.4 Ų
- LogP: 2.7