Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:44:57 UTC
Update Date2025-03-21 22:55:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00592269
Frequency2.7
Structure
Chemical FormulaC9H13N
Molecular Mass135.1048
SMILESCc1ccc(CN)c(C)c1
InChI KeyGBSUVYGVEQDZPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent m-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • m-xylene
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound