Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:15 UTC
Update Date2025-03-21 18:33:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096218
Frequency28.7
Structure
Chemical FormulaC15H19N
Molecular Mass213.1518
SMILESCC1(C)CCC(C)(C)c2cc(C#N)ccc21
InChI KeyMHTZJQCDPRSBKF-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