Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:23:30 UTC
Update Date2025-03-21 20:54:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00398760
Frequency4.6
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCCN(C)Cc1ccco1
InChI KeyCMDGRXHSCWBDQH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • furan
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aralkylamine
  • oxacycle
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound