Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:57:51 UTC
Update Date2025-03-21 18:05:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00057073
Frequency55.7
Structure
Chemical FormulaC13H21NO
Molecular Mass207.1623
SMILESCC(C)N(C)C(C)C(O)c1ccccc1
InChI KeyGELUVKOLHCNODS-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