Molecule ID: 25164051

IUPAC Name: 2,5-dimethoxy-3,6-bis[1-(2-methylbut-3-en-2-yl)indol-3-yl]cyclohexa-2,5-diene-1,4-dione

Description: The molecule is a member of the class of asterriquinones that is asterriquinone in which the hydrogens of both of the hydroxy groups have replaced by methyl groups.

SMILES: C=CC(C)(C)n1cc(C2=C(OC)C(=O)C(c3cn(C(C)(C)C=C)c4ccccc34)=C(OC)C2=O)c2ccccc21

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

InChI: InChI=1S/C34H34N2O4/c1-9-33(3,4)35-19-23(21-15-11-13-17-25(21)35)27-29(37)32(40-8)28(30(38)31(27)39-7)24-20-36(34(5,6)10-2)26-18-14-12-16-22(24)26/h9-20H,1-2H2,3-8H3

Molecular Properties:
- Polar Surface Area: 62.5 Ų
- LogP: 6.5