Molecule ID: 54699185

IUPAC Name: 6-hydroxy-5-methoxy-7-(4-methoxyphenyl)-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-g]chromen-8-one

Description: The molecule is a hydroxycoumarin that is 2H,8H-benzo[1,2-b:5,4-b']dipyran-2-one substituted by a hydroxy group at position 4, a methoxy group at position 5, 4-methoxyphenyl group at position 3 and two methyl groups at position 8 respectively. It has a role as a plant metabolite and an antiprotozoal drug. It is a hydroxycoumarin and a monomethoxybenzene.

SMILES: COc1ccc(-c2c(O)c3c(OC)c4c(c(CC=C(C)C)c3oc2=O)OC(C)(C)C=C4)cc1

SELFIES: [C][O][C][=C][C][=C][Branch2][Ring2][P][C][=C][Branch1][C][O][C][=C][Branch1][Ring1][O][C][C][=C][Branch2][Ring1][Ring2][C][Branch1][Branch2][C][C][=C][Branch1][C][C][C][=C][Ring1][=N][O][C][Ring2][Ring1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][C][C][=C][Ring2][Ring1][#C]

InChI: InChI=1S/C27H28O6/c1-15(2)7-12-18-23-19(13-14-27(3,4)33-23)24(31-6)21-22(28)20(26(29)32-25(18)21)16-8-10-17(30-5)11-9-16/h7-11,13-14,28H,12H2,1-6H3

Molecular Properties:
- Polar Surface Area: 74.2 Ų
- LogP: 5.7