Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:21:15 UTC
Update Date2025-03-21 20:53:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00393329
Frequency4.7
Structure
Chemical FormulaC6H12N2O
Molecular Mass128.095
SMILESCC1(C)CC(N)C(O)=N1
InChI KeyZKJJTORZUUTCBS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • pyrroline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound