Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:14 UTC
Update Date2025-03-25 00:56:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220415
Frequency0.5
Structure
Chemical FormulaC9H9NO2
Molecular Mass163.0633
SMILESCOC1=Nc2ccccc2OC1
InChI KeyQQXBBHKXHNNSFT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • imidolactones
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • ether
  • azacycle
  • benzoxazine
  • organic 1,3-dipolar compound
  • alkyl aryl ether
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • imidolactone
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound