Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-21 15:12:49 UTC
Update Date2025-03-25 00:58:24 UTC
HMDB IDHMDB0254656
Metabolite Identification
DeepMet IDDMID02230553
NameMethylone
Frequency0.5
Structure
Chemical FormulaC11H13NO3
Molecular Mass207.0895
SMILESCNC(C)C(=O)c1ccc2c(c1)OCO2
InChI KeyVKEQBMCRQDSRET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • aryl alkyl ketones
  • benzenoids
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • secondary aliphatic amine
  • aryl alkyl ketone
  • secondary amine
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • aryl ketone
  • benzodioxole