Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:41 UTC
Update Date2025-03-25 00:48:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168587
Frequency0.5
Structure
Chemical FormulaC13H25NO
Molecular Mass211.1936
SMILESCC(C)(O)C1CCC(N2CCCC2)CC1
InChI KeyFAEKAOICIVQAFF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass cyclohexylamines
Direct Parent cyclohexylamines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • cyclohexylamine
  • tertiary alcohol
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • pyrrolidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound