Molecule ID: 5281661

IUPAC Name: 1,2,8-trihydroxy-6-methoxyxanthen-9-one

Description: The molecule is a member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 2 and 8 and a methoxy group at position 6. It has been isolated from various species of the genus Swertia and has been found to exhibit antioxidant activities. It has a role as an antioxidant and a plant metabolite. It is a member of xanthones, a polyphenol and an aromatic ether.

SMILES: COc1cc(O)c2c(=O)c3c(O)c(O)ccc3oc2c1

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

InChI: InChI=1S/C14H10O6/c1-19-6-4-8(16)11-10(5-6)20-9-3-2-7(15)13(17)12(9)14(11)18/h2-5,15-17H,1H3

Molecular Properties:
- Polar Surface Area: 96.2 Ų
- LogP: 2.4