Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:39 UTC
Update Date2025-03-21 18:41:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00135512
Frequency18.5
Structure
Chemical FormulaC16H27NO2
Molecular Mass265.2042
SMILESCC(C)(C)c1cc(C(O)CN)cc(C(C)(C)C)c1O
InChI KeyBNKOODGJLDZCCW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • phenols
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound