Molecule ID: 5281622

IUPAC Name: 1,6,7-trihydroxy-3-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, 6 and 7 and a methoxy group at position 3. It has a role as a plant metabolite. It is a member of xanthones, a polyphenol and an aromatic ether.

SMILES: COc1cc(O)c2c(=O)c3cc(O)c(O)cc3oc2c1

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

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

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