Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:56 UTC
Update Date2025-03-25 00:52:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194198
Frequency0.5
Structure
Chemical FormulaC9H17NO3
Molecular Mass187.1208
SMILESCN(O)CC(=O)C1(O)CCCCC1
InChI KeyYMBIHJYMWQCDPO-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
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • n-organohydroxylamines
  • organic oxides
  • organopnictogen compounds
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • cyclohexanol
  • cyclic alcohol
  • n-organohydroxylamine
  • ketone
  • tertiary alcohol
  • organic oxide
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound