Molecule ID: 5280520

IUPAC Name: 3-(2,4-dihydroxyphenyl)-7-hydroxychromen-4-one

Description: The molecule is a hydroxyisoflavone that is daidzein bearing an additional hydroxy substituent at position 2'. It has a role as an anti-inflammatory agent. It derives from a daidzein. It is a conjugate acid of a 2'-hydroxydaidzein(1-).

SMILES: O=c1c(-c2ccc(O)cc2O)coc2cc(O)ccc12

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

InChI: InChI=1S/C15H10O5/c16-8-1-3-10(13(18)5-8)12-7-20-14-6-9(17)2-4-11(14)15(12)19/h1-7,16-18H

Molecular Properties:
- Polar Surface Area: 87.0 Ų
- LogP: 2.1