Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:03 UTC
Update Date2025-03-25 00:54:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208240
Frequency0.5
Structure
Chemical FormulaC13H19N
Molecular Mass189.1518
SMILESCC(C)c1ccc(C2CCCN2)cc1
InChI KeyZYXHXFDDXNHWHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic monoterpenoids
  • azacyclic compounds
  • cumenes
  • dialkylamines
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organopnictogen compounds
  • phenylpropanes
  • pyrroles
  • Substituents
  • monoterpenoid
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • monocyclic monoterpenoid
  • aromatic heteromonocyclic compound
  • azacycle
  • 2-phenylpyrrolidine
  • p-cymene
  • secondary amine
  • phenylpropane
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • cumene
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • aromatic monoterpenoid