Molecule ID: 5376891

IUPAC Name: 7-hydroxy-3-phenylchromen-4-one

Description: The molecule is the simplest member of the class of 7-hydroxyisoflavones that is isoflavone with a hydroxy substituent at position 7. It has a role as an EC 1.14.14.14 (aromatase) inhibitor and a metabolite. It is a conjugate acid of a 7-hydroxyisoflavone(1-).

SMILES: O=c1c(-c2ccccc2)coc2cc(O)ccc12

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

InChI: InChI=1S/C15H10O3/c16-11-6-7-12-14(8-11)18-9-13(15(12)17)10-4-2-1-3-5-10/h1-9,16H

Molecular Properties:
- Polar Surface Area: 46.5 Ų
- LogP: 2.8