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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:55 UTC
Update Date2025-03-25 00:47:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160017
Frequency0.5
Structure
Chemical FormulaC5H2F3N5O2
Molecular Mass221.0161
SMILESO=c1[nH]c(=O)n2nc(C(F)(F)F)nc2[nH]1
InChI KeyFVZGPGHPDZXOTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass triazinones
Direct Parent triazinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl fluorides
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • triazoles
  • Substituents
  • triazole
  • carbonic acid derivative
  • 1,2,4-triazole
  • azacycle
  • alkyl fluoride
  • organofluoride
  • heteroaromatic compound
  • organohalogen compound
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • halo-s-triazine
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • triazinone
  • organooxygen compound
  • azole