Chem
J-GLOBAL ID:200907052330425148   Nikkaji number:J4.901H

Toxoflavin

トキソフラビン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C7H7N5O2
Molecular formula furigana: C7-H7-N5-O2
Molecular weight: 193.166
InChI: InChI=1S/C7H7N5O2/c1-11-6(13)4-5(10-7(11)14)12(2)9-3-8-4/h3H,1-2H3
InChI key: SLGRAIAQIAUZAQ-UHFFFAOYSA-N
SMILES: Cn1ncnc2c1nc(=O)n(C)c2=O
Systematic name  (4):
  • 1,6-ジメチル-5,7-ジオキソ-1,5,6,7-テトラヒドロピリミド[5,4-e]-as-トリアジン
  • 1,6-ジメチルピリミド[5,4-e][1,2,4]トリアジン-5,7(1H,6H)-ジオン
  • 1,6-ジメチル-1H,5H,6H,7H-ピリミド[5,4-e][1,2,4]トリアジン-5,7-ジオン
  • 1,6-dimethyl-1H,5H,6H,7H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
Other name (6):
  • トキソフラビン
  • キサントトリシン
  • Toxoflavin
  • Xanthothricin
  • 1,6-Dimethyl-5,7-dioxo-1,5,6,7-tetrahydropyrimido[5,4-e]-as-triazine
Show all
CAS registry number: 84-82-2
Regulation number (1):
  • UW7875000
KEGG COMPOUND: C16789
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