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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:23 UTC
Update Date2025-03-25 00:47:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158856
Frequency0.5
Structure
Chemical FormulaC14H13NO4
Molecular Mass259.0845
SMILESOc1ccc(C2Oc3ccccc3N(O)C2O)cc1
InChI KeyBRMZLUWMWUCKHP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxylamino, 2-unsubstituted benzenoids
  • 1-hydroxylamino, 4-unsubstituted benzenoids
  • alkanolamines
  • alkyl aryl ethers
  • azacyclic compounds
  • benzene and substituted derivatives
  • benzomorpholines
  • hydrocarbon derivatives
  • n-organohydroxylamines
  • organopnictogen compounds
  • oxacyclic compounds
    • Substituents
  • monocyclic benzene moiety
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • benzomorpholine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 1-hydroxylamino, 2-unsubstituted benzenoid
  • alkanolamine
  • azacycle
  • benzoxazine
  • n-organohydroxylamine
  • oxazinane
  • oxacycle
  • morpholine
  • organic oxygen compound
  • phenol
  • 1-hydroxylamino, 4-unsubstituted benzenoid
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound