Molecule ID: 5465785

IUPAC Name: 1,7-dihydroxy-4-methoxyxanthen-9-one

Description: The molecule is a member of the class of xanthones that is 9H-xanthene substituted by hydroxy groups at positions 1 and 7, a methoxy group at position 4 and an oxo group at position 9. It has been isolated from the stems of Cratoxylum cochinchinense. It has a role as a metabolite and a plant metabolite. It is an aromatic ether, a member of phenols and a member of xanthones.

SMILES: COc1ccc(O)c2c(=O)c3cc(O)ccc3oc12

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

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

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