Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:24:25 UTC
Update Date2025-03-24 22:03:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01977279
Frequency0.6
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCN(C)C1C=CC(=O)CC1
InChI KeyVWXZWVKQBGEFNG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • cyclohexenone
  • tertiary aliphatic amine
  • organic oxide
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine