Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:29 UTC
Update Date2025-03-21 18:31:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00087195
Frequency32.6
Structure
Chemical FormulaC9H11NO
Molecular Mass149.0841
SMILESCN1CCOc2ccccc21
InChI KeyYJRQBOOMJGYUPI-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
  • benzomorpholines
  • dialkylarylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • ether
  • azacycle
  • benzoxazine
  • alkyl aryl ether
  • benzomorpholine
  • oxazinane
  • oxacycle
  • morpholine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • amine
  • tertiary amine
  • organooxygen compound