Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:24 UTC
Update Date2025-03-21 18:35:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106440
Frequency25.3
Structure
Chemical FormulaC11H17N
Molecular Mass163.1361
SMILESCNC(c1ccccc1)C(C)C
InChI KeyJWEORWDKFFDSLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • secondary aliphatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • secondary amine
  • amine