Hmdb loader

Showing information for DMID00108904

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:24 UTC
Update Date2025-03-21 18:36:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108904
Frequency24.6
Structure
Chemical FormulaC7H9NO4
Molecular Mass171.0532
SMILESO=C(O)C1=NCCCC1C(=O)O
InChI KeyIRFNJUNRFOPHMT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketimines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • ketimine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • imine
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound