Hmdb loader

Showing information for DMID02149986

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:31 UTC
Update Date2025-03-25 00:45:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149986
Frequency0.5
Structure
Chemical FormulaC14H16FN3O2
Molecular Mass277.1227
SMILESCC1COc2c(N3CCOCC3)c(F)cc3ncn1c23
InChI KeyKZDJFIRMUHJBOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • aryl fluorides
  • azacyclic compounds
  • benzenoids
  • benzimidazoles
  • dialkyl ethers
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • morpholines
  • n-substituted imidazoles
  • organofluorides
  • organopnictogen compounds
  • oxacyclic compounds
    • Substituents
  • aryl fluoride
  • ether
  • alkyl aryl ether
  • organohalogen compound
  • dialkyl ether
  • aromatic heteropolycyclic compound
  • benzimidazole
  • imidazole
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • azole
  • n-substituted imidazole
  • azacycle
  • organofluoride
  • heteroaromatic compound
  • benzoxazine
  • oxazinane
  • aryl halide
  • oxacycle
  • morpholine
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound