Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:48:34 UTC
Update Date2025-03-24 17:58:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01030786
Frequency1.4
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESCC(C)C(O)C1CN1
InChI KeyUWSOFWZVLKRWPT-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
  • aziridines
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • aziridine
  • organoheterocyclic compound
  • amine