Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:57 UTC
Update Date2025-03-25 00:58:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230875
Frequency0.5
Structure
Chemical FormulaC19H32NO5+
Molecular Mass354.2275
SMILESCCCCCCCCc1ccc[n+](C2OC(CO)C(O)C(O)C2O)c1
InChI KeyCQWFQESPZHDHTA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydroxypyridines
Direct Parent hydroxypyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • monosaccharides
  • organic cations
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • monosaccharide
  • methylpyridine
  • oxacycle
  • saccharide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • oxane
  • primary alcohol
  • organooxygen compound