Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:28 UTC
Update Date2025-03-25 00:59:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238897
Frequency0.5
Structure
Chemical FormulaC15H12FNOS
Molecular Mass273.0624
SMILESO=CN1CC(c2ccc(F)cc2)Sc2ccccc21
InChI KeyWBUOQVKESAZWFD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiazines
Subclass benzothiazines
Direct Parent benzothiazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-thiazines
  • alkylarylthioethers
  • aryl fluorides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fluorobenzenes
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • carbonyl group
  • benzothiazine
  • alkylarylthioether
  • carboxylic acid derivative
  • organohalogen compound
  • aryl thioether
  • fluorobenzene
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • para-thiazine
  • azacycle
  • organofluoride
  • carboxamide group
  • aryl halide
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound