Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:22:18 UTC
Update Date2025-03-24 20:43:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01543877
Frequency0.8
Structure
Chemical FormulaC4H9NO
Molecular Mass87.0684
SMILESNC1CC(O)C1
InChI KeyJLUZCHOYSPEHES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • cyclobutanol
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound