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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:25 UTC
Update Date2025-03-25 00:56:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218496
Frequency0.5
Structure
Chemical FormulaC11H18NO7P
Molecular Mass307.0821
SMILESCc1ncc(COP(=O)(O)OCC(C)O)c(CO)c1O
InChI KeyYKRPERSRWIDFSR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridoxines
Direct Parent pyridoxines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • dialkyl phosphates
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • aromatic heteromonocyclic compound
  • polyhalopyridine
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • pyridoxine
  • dialkyl phosphate
  • organic oxygen compound
  • phosphoric acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound