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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:45:13 UTC
Update Date2025-03-24 20:53:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01598270
Frequency0.8
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESCN1CC2OC=CC2C1=O
InChI KeyFNWHHCDXPNJAMN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfuropyrroles
Subclass furopyrroles
Direct Parent furopyrroles
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dihydrofurans
  • furans
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrroles
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • furan
  • carbonyl group
  • lactam
  • carboxylic acid derivative
  • furopyrrole
  • aliphatic heteropolycyclic compound
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • dihydrofuran
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • oxacycle
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound