Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:52:24 UTC
Update Date2025-03-24 14:37:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00896140
Frequency1.6
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESNC1CCC(O)(C=O)CC1
InChI KeySLBIXTGWXMIFHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • aldehydes
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • cyclohexanol
  • aldehyde
  • cyclic alcohol
  • tertiary alcohol
  • organic oxide
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound