Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:04:45 UTC
Update Date2025-03-24 21:28:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01788494
Frequency0.7
Structure
Chemical FormulaC7H15NO
Molecular Mass129.1154
SMILESCC(C)(O)CC1CNC1
InChI KeyJKJFADJVKHTNOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • azetidine
  • tertiary alcohol
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • amine