Molecule ID: 70698346

IUPAC Name: 7,8-dimethyl-2,4-dioxobenzo[g]pteridine-10-carbaldehyde

Description: The molecule is a flavin carrying a formyl group at C-10. It is a flavin and an amide. It derives from a 7,8-dimethylisoalloxazine.

SMILES: Cc1cc2nc3c(O)nc(=O)nc-3n(C=O)c2cc1C

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

InChI: InChI=1S/C13H10N4O3/c1-6-3-8-9(4-7(6)2)17(5-18)11-10(14-8)12(19)16-13(20)15-11/h3-5H,1-2H3,(H,16,19,20)

Molecular Properties:
- Polar Surface Area: 91.2 Ų
- LogP: 0.9