Molecule ID: 45267938

IUPAC Name: 5,7-dihydroxy-6-methoxy-2-methylchromen-4-one

Description: The molecule is a member of the class of chromones that is chromone substituted by hydroxy groups at positions 5 and 7, a methoxy groups at position 6 and a methyl group at position 2. Isolated from Pisonia aculeata, it exhibits antitubercular activity. It has a role as a metabolite, an antitubercular agent and a plant metabolite. It is an aromatic ether, a member of resorcinols and a member of chromones. It derives from a chromone.

SMILES: COc1c(O)cc2oc(C)cc(=O)c2c1O

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

InChI: InChI=1S/C11H10O5/c1-5-3-6(12)9-8(16-5)4-7(13)11(15-2)10(9)14/h3-4,13-14H,1-2H3

Molecular Properties:
- Polar Surface Area: 76.0 Ų
- LogP: 1.7