Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:16:16 UTC
Update Date2025-03-21 22:13:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00523563
Frequency3.2
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESCNCC(O)C1CC1
InChI KeyYCRCLAWGWVSYLW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • secondary amine
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine