EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:37323 - 7,8-dimethylisoalloxazine

ChEBI IDCHEBI:37323
ChEBI Name7,8-dimethylisoalloxazine
Stars
DefinitionA 7,8-dimethylbenzo[g]pteridine-2,4-dione that is isoalloxazine substituted by methyl groups at positions 7 and 8.
Last Modified14 July 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H10N4O2
Net Charge0
Average Mass242.238
Monoisotopic Mass242.08038
SMILESCc1cc2nc3nc(=O)nc(=O)c-3nc2cc1C
InChIInChI=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)
InChIKeyZJTJUVIJVLLGSP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7,8-dimethylisoalloxazine (CHEBI:37323) has functional parent isoalloxazine (CHEBI:37327)
7,8-dimethylisoalloxazine (CHEBI:37323) is a 7,8-dimethylbenzo[g]pteridine-2,4-dione (CHEBI:37324)
7,8-dimethylisoalloxazine (CHEBI:37323) is tautomer of lumichrome (CHEBI:17781)
Incoming Relation(s)
7,8-dimethylisoalloxazine-10-carbaldehyde (CHEBI:71525) has functional parent 7,8-dimethylisoalloxazine (CHEBI:37323)
flavin (CHEBI:30527) has functional parent 7,8-dimethylisoalloxazine (CHEBI:37323)
lumichrome (CHEBI:17781) is tautomer of 7,8-dimethylisoalloxazine (CHEBI:37323)
IUPAC Name 
7,8-dimethylbenzo[g]pteridine-2,4(3H,10H)-dione
Synonym  Source
dimethylisoalloxazineIUPAC
Registry NumbersSources
Reaxys:539579Reaxys
Citations