Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:03 UTC
Update Date2025-03-21 18:40:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129571
Frequency19.6
Structure
Chemical FormulaC13H21N
Molecular Mass191.1674
SMILESCN(C)Cc1ccc(C(C)(C)C)cc1
InChI KeyNLVFHLWFCBHNDQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aralkylamines
  • benzylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylmethylamines
  • trialkylamines
  • Substituents
  • tertiary aliphatic amine
  • aralkylamine
  • phenylpropane
  • aromatic homomonocyclic compound
  • phenylmethylamine
  • benzylamine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine