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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:26 UTC
Update Date2025-03-21 17:57:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00007140
Frequency713.3
Structure
Chemical FormulaC16H25NO
Molecular Mass247.1936
SMILESCN(C)CC(c1ccccc1)C1(O)CCCCC1
InChI KeyQOVGVRHIJYHFST-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • benzene and substituted derivatives
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • 1,3-aminoalcohol
  • tertiary aliphatic amine
  • cyclohexanol
  • cyclic alcohol
  • aromatic homomonocyclic compound
  • tertiary alcohol
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine