Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:04:57 UTC
Update Date2025-03-24 20:35:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01501476
Frequency0.9
Structure
Chemical FormulaC6H12N2O
Molecular Mass128.095
SMILESCC(O)C1CNCC=N1
InChI KeyXOUWVCXNUQVXIV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • secondary amine
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • amine