Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:58 UTC
Update Date2025-03-25 00:50:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178470
Frequency0.5
Structure
Chemical FormulaC10H14N+
Molecular Mass148.1121
SMILESCc1ccccc1C=[N+](C)C
InChI KeyIKQVDAPRCOLKFY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent toluenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • toluene