Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:30 UTC
Update Date2025-03-25 00:58:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02232154
Frequency0.5
Structure
Chemical FormulaC12H17N
Molecular Mass175.1361
SMILESCCC1(c2ccccc2)CN(C)C1
InChI KeyYTVKEWBEIJLAFK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazetidines
Subclass phenylazetidines
Direct Parent phenylazetidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • 3-phenylazetidine
  • tertiary aliphatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine