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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:50 UTC
Update Date2025-03-25 01:01:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02249002
Frequency0.5
Structure
Chemical FormulaC10H11NO3
Molecular Mass193.0739
SMILESCOc1ccc2c(c1)OCC(C=O)N2
InChI KeyCFNZULXXPNYCIY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aldehydes
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • benzomorpholines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alkylarylamines
    • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • alkyl aryl ether
  • benzomorpholine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • azacycle
  • aldehyde
  • benzoxazine
  • secondary amine
  • oxazinane
  • secondary aliphatic/aromatic amine
  • oxacycle
  • morpholine
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound