Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:04 UTC
Update Date2025-03-25 00:48:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169449
Frequency0.5
Structure
Chemical FormulaC11H16N2O4
Molecular Mass240.111
SMILESCCCCCCOC(=O)c1[nH]cnc1C(=O)O
InChI KeyWBBUVMDDRSRTAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent carbonylimidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • imidazole-4-carbonyl group
  • organic nitrogen compound
  • organooxygen compound