Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:42:49 UTC
Update Date2025-03-24 21:18:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01737013
Frequency0.7
Structure
Chemical FormulaC7H9NO
Molecular Mass123.0684
SMILESC=CNCc1ccco1
InChI KeyZDSJDIJTFDLGLQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • furan
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • secondary amine
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine