Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:47 UTC
Update Date2025-03-25 00:51:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189442
Frequency0.5
Structure
Chemical FormulaC14H21N
Molecular Mass203.1674
SMILESCC(C)c1cccc(CC2CCCN2)c1
InChI KeyLGADQRRSVWHLBA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylpropanes
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • secondary amine
  • phenylpropane
  • organonitrogen compound
  • organopnictogen compound
  • cumene
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • amine