Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:41:01 UTC
Update Date2025-03-21 22:54:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00582784
Frequency2.8
Structure
Chemical FormulaC6H5NO3
Molecular Mass139.0269
SMILESO=C1NC(=O)C2OC=CC12
InChI KeyYUXOYHAJFPQNBH-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
  • dicarboximides
  • dihydrofurans
  • furans
  • hydrocarbon derivatives
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrroles
  • pyrrolidine-2-ones
  • Substituents
  • 2-pyrrolidone
  • furan
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • carboxylic acid imide
  • furopyrrole
  • aliphatic heteropolycyclic compound
  • oxacycle
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organooxygen compound
  • dihydrofuran