Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:20:42 UTC
Update Date2025-03-24 16:47:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00964360
Frequency1.5
Structure
Chemical FormulaC4H9NO2
Molecular Mass103.0633
SMILESNC1CC(O)C1O
InChI KeyASZLGMVFADHXIG-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
  • 1,2-diols
  • 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
  • 1,2-diol