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Record Information
HMDB Statusexpected
Creation Date2024-02-21 02:41:43 UTC
Update Date2025-03-21 21:55:35 UTC
HMDB IDHMDB0002818
Metabolite Identification
DeepMet IDDMID00442177
NameAlloxan
Frequency4.0
Structure
Chemical FormulaC4H2N2O4
Molecular Mass142.0015
SMILESO=C1NC(=O)C(=O)C(=O)N1
InChI KeyHIMXGTXNXJYFGB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent barbituric acid derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids and derivatives
  • cyclic ketones
  • diazinanes
  • dicarboximides
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • barbiturate
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • organooxygen compound