Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:41:29 UTC
Update Date2025-03-21 18:48:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00160807
Frequency14.8
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESNCCc1ccc(CO)o1
InChI KeyFXIRVYXQUGFFLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • furan
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound