Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:36:18 UTC
Update Date2025-03-21 18:46:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00148655
Frequency16.4
Structure
Chemical FormulaC9H13N
Molecular Mass135.1048
SMILESCCCc1ccc(N)cc1
InChI KeyOAPDPORYXWQVJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine