Molecule ID: 42631473

IUPAC Name: 9-hydroxy-6-methyl-[1,3]dioxolo[4,5-g]chromen-8-one

Description: The molecule is a member of the class of chromones that is chromone substituted by a hydroxy group at position 5, a methyl group at position 2 and a methylenedioxy group across positions 6 and 7. It has been isolated from Pisonia aculeata. It has a role as a metabolite and a plant metabolite. It is a member of chromones, an organic heterotricyclic compound and a member of phenols.

SMILES: Cc1cc(=O)c2c(O)c3c(cc2o1)OCO3

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

InChI: InChI=1S/C11H8O5/c1-5-2-6(12)9-7(16-5)3-8-11(10(9)13)15-4-14-8/h2-3,13H,4H2,1H3

Molecular Properties:
- Polar Surface Area: 65.0 Ų
- LogP: 1.9