Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:31:32 UTC
Update Date2025-03-21 19:21:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00277335
Frequency7.3
Structure
Chemical FormulaC9H13N
Molecular Mass135.1048
SMILESCc1cccc(CN)c1C
InChI KeyUKLRWOHZBISUMI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent o-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • o-xylene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound