Molecule ID: 5273569

IUPAC Name: 7,8-dihydroxy-6-methoxychromen-2-one

Description: The molecule is a hydroxycoumarin that is 6-methoxycoumarin in which the hydrogens at positions 7 and 8 have been replaced by hydroxy groups. It has a role as an Arabidopsis thaliana metabolite, an antimicrobial agent, an apoptosis inhibitor, an apoptosis inducer, an antioxidant, an anti-inflammatory agent, a hepatoprotective agent, an antibacterial agent and a hypoglycemic agent. It is a hydroxycoumarin and an aromatic ether.

SMILES: COc1cc2ccc(=O)oc2c(O)c1O

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

InChI: InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3

Molecular Properties:
- Polar Surface Area: 76.0 Ų
- LogP: 1.2