Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:59 UTC
Update Date2025-03-25 00:50:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178517
Frequency0.5
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESCNCCc1ccc(O)o1
InChI KeyLTAFKXKWTBHKBT-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