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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:54:40 UTC
Update Date2025-03-24 22:24:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01189415
Frequency1.1
Structure
Chemical FormulaC9H13N
Molecular Mass135.1048
SMILESC=CC1=C(C)C(C)NC1=C
InChI KeyYKVYATMDOUMVGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
    • Substituents
  • secondary aliphatic amine
  • pyrroline
  • azacycle
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • secondary amine
  • amine