Hmdb loader

Showing information for DMID02222211

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:01 UTC
Update Date2025-03-25 00:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222211
Frequency0.5
Structure
Chemical FormulaC16H20N2O6
Molecular Mass336.1321
SMILESOCC1OC(NCc2cnc3c(O)cccc3c2)C(O)C(O)C1O
InChI KeyPQXOMYXOGPYMIU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass 8-hydroxyquinolines
Direct Parent 8-hydroxyquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 2-halopyridines
  • azacyclic compounds
  • benzenoids
  • dialkylamines
  • hemiaminals
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monosaccharides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • polyhalopyridines
  • primary alcohols
  • secondary alcohols
    • Substituents
  • polyhalopyridine
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • hemiaminal
  • saccharide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • oxane
  • primary alcohol
  • alcohol
  • secondary aliphatic amine
  • 8-hydroxyquinoline
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • 1-hydroxy-4-unsubstituted benzenoid
  • secondary amine
  • oxacycle
  • pyridine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine