Molecule ID: 5326566

IUPAC Name: 7,8-dimethyl-1H-benzo[g]pteridine-2,4-dione

Description: The molecule is a compound showing blue fluorescence, formed by a photolysis of riboflavin in acid or neutral solution. It has a role as a plant metabolite. It derives from an alloxazine. It is a tautomer of a 7,8-dimethylisoalloxazine.

SMILES: Cc1cc2nc3nc(O)nc(O)c3nc2cc1C

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

InChI: InChI=1S/C12H10N4O2/c1-5-3-7-8(4-6(5)2)14-10-9(13-7)11(17)16-12(18)15-10/h3-4H,1-2H3,(H2,14,15,16,17,18)

Molecular Properties:
- Polar Surface Area: 84.0 Ų
- LogP: 1.1