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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:46 UTC
Update Date2025-03-25 00:59:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237318
Frequency0.5
Structure
Chemical FormulaC10H14NO6P
Molecular Mass275.0559
SMILESO=C(Cc1ccc(OP(=O)(O)O)cc1)NCCO
InChI KeyYSPAMYIYKIWLOU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phenyl phosphates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acylethanolamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phenylacetamides
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • phenylacetamide
  • alkanolamine
  • alcohol
  • phenyl phosphate
  • carboxamide group
  • n-acylethanolamine
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound