Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:20 UTC
Update Date2025-03-21 18:31:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00086894
Frequency32.8
Structure
Chemical FormulaC14H23NO
Molecular Mass221.178
SMILESCN(C)CC(O)c1ccc(C(C)(C)C)cc1
InChI KeyIWTKLJPCUATLRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • aromatic alcohols
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • alcohol
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound