Molecule ID: 60158906

IUPAC Name: 1,8-dihydroxy-2-methoxyxanthen-9-one

Description: The molecule is a member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy group at positions 1 and 8 and a methoxy group at position 2. It has been isolated from Chaetomium globosum.( Compound class : xanthenone) It has a role as a Chaetomium metabolite. It is a polyphenol, an aromatic ether and a member of xanthones.

SMILES: COc1ccc2oc3cccc(O)c3c(=O)c2c1O

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

InChI: InChI=1S/C14H10O5/c1-18-10-6-5-9-12(13(10)16)14(17)11-7(15)3-2-4-8(11)19-9/h2-6,15-16H,1H3

Molecular Properties:
- Polar Surface Area: 76.0 Ų
- LogP: 2.8