Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:18 UTC
Update Date2025-03-25 00:52:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02192774
Frequency0.5
Structure
Chemical FormulaC14H21NO2
Molecular Mass235.1572
SMILESCCCC=CCCCC(O)=NCc1ccco1
InChI KeyJAAPKWXGTFGVQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carboximidic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • furan
  • carboximidic acid
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound