Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:58 UTC
Update Date2025-03-25 00:49:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171535
Frequency0.5
Structure
Chemical FormulaC8H11NO2
Molecular Mass153.079
SMILESCN(C)Cc1occc1C=O
InChI KeyBPPGMXZDMRWXJH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl-aldehydes
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • furan
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aldehyde
  • aralkylamine
  • oxacycle
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound