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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:54 UTC
Update Date2025-03-21 18:36:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00112535
Frequency23.6
Structure
Chemical FormulaC9H19NO2
Molecular Mass173.1416
SMILESCNCC(O)C1(O)CCCCC1
InChI KeyGQQXVDBRPVWFAI-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
  • 1,2-diols
  • cyclic alcohols and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tertiary alcohols
    • Substituents
  • secondary aliphatic amine
  • cyclohexanol
  • cyclic alcohol
  • secondary amine
  • tertiary alcohol
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • 1,2-diol