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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:44:32 UTC
Update Date2025-03-21 18:00:10 UTC
HMDB IDHMDB0059856
Metabolite Identification
DeepMet IDDMID00025572
NameEthyl 2-pyrrolecarboxylate
Frequency150.8
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESCCOC(=O)c1ccc[nH]1
InChI KeyPAEYAKGINDQUCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass pyrrole carboxylic acids and derivatives
Direct Parent pyrrole carboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrrole-2-carboxylic acid or derivatives
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound