Hmdb loader

Showing information for DMID02198388

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:46 UTC
Update Date2025-03-25 00:53:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198388
Frequency0.5
Structure
Chemical FormulaC15H16N2O4
Molecular Mass288.111
SMILESCc1ncc(COc2ccccc2C(=O)O)c(CN)c1O
InChI KeyCUUYHMFBYDSTHX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridoxamines
Direct Parent pyridoxamine 5'-phosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 2-halopyridines
  • alkyl aryl ethers
  • azacyclic compounds
  • benzoic acids
  • benzoyl derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • polyhalopyridines
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • polyhalopyridine
  • benzoyl
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 1-carboxy-2-haloaromatic compound
  • 2-halopyridine
  • benzoic acid
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • benzoic acid or derivatives
  • pyridoxamine 5'-phosphate
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound