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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:48:47 UTC
Update Date2025-03-21 22:57:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00601408
Frequency2.7
Structure
Chemical FormulaC2H5N3O
Molecular Mass87.0433
SMILES[O-][N+]1=NCCN1
InChI KeyHCXDGAVNOQJWBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass triazolines
Direct Parent triazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • allyl-type 1,3-dipolar organic compounds
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • azacycle
  • allyl-type 1,3-dipolar organic compound
  • triazoline
  • organic 1,3-dipolar compound
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic hyponitrite