Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:42 UTC
Update Date2025-03-25 00:53:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198258
Frequency0.5
Structure
Chemical FormulaC17H23N
Molecular Mass241.183
SMILESCc1ccc2c(c1)C(C)(C)CCC2(C)CCC#N
InChI KeyJAXWGEMYTCCAJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • nitriles
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • tetralin
  • nitrile
  • organonitrogen compound
  • organopnictogen compound
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • carbonitrile