Molecule ID: 44257375

IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5,6,7,8-tetramethoxychromen-4-one

Description: The molecule is a methoxyisoflavone that is isoflavone substituted by methoxy groups at positions 5, 6, 7 and 8 and methylenedioxy group across positions 3' and 4'. It has a role as a plant metabolite. It is a member of benzodioxoles and a member of 7-methoxyisoflavones.

SMILES: COc1c(OC)c(OC)c2c(=O)c(-c3ccc4c(c3)OCO4)coc2c1OC

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

InChI: InChI=1S/C20H18O8/c1-22-16-14-15(21)11(10-5-6-12-13(7-10)28-9-27-12)8-26-17(14)19(24-3)20(25-4)18(16)23-2/h5-8H,9H2,1-4H3

Molecular Properties:
- Polar Surface Area: 81.7 Ų
- LogP: 2.9