Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:34 UTC
Update Date2025-03-21 18:02:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00037560
Frequency93.7
Structure
Chemical FormulaC6H16N2O
Molecular Mass132.1263
SMILESNCCCCC(O)CN
InChI KeyQKJWCMWLFMRPLU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound