Hmdb loader

Showing information for DMID02157264

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:40 UTC
Update Date2025-03-25 00:46:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157264
Frequency0.5
Structure
Chemical FormulaC17H14NO4+
Molecular Mass296.0917
SMILESO=C1CCc2cc3c(cc2O1)CC[n+]1cc2c(cc1-3)OCO2
InChI KeyGKWNNTQWTMLRTH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent chromenopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • 3,4-dihydrocoumarins
  • acetals
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • pyridines and derivatives
  • quinolizines
    • Substituents
  • carbonyl group
  • polyhalopyridine
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • organic cation
  • quinolizine
  • azacycle
  • heteroaromatic compound
  • 3,4-dihydrocoumarin
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • benzenoid
  • chromenopyridine
  • organic nitrogen compound
  • organooxygen compound