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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:04:45 UTC
Update Date2025-03-21 22:08:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00496641
Frequency3.5
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCC1(C)N=C(N)CCC1=O
InChI KeyASFVBPWCAAKFQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • cyclic ketones
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • carbonyl group
  • azacycle
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • cyclic ketone
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • organooxygen compound