Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:36:55 UTC
Update Date2025-03-21 17:57:30 UTC
HMDB IDHMDB0255850
Metabolite Identification
DeepMet IDDMID00008270
NameO-Demethylmetoprolol
Frequency594.0
Structure
Chemical FormulaC14H23NO3
Molecular Mass253.1678
SMILESCC(C)NCC(O)COc1ccc(CCO)cc1
InChI KeyCUKXSBOAIJILRY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass tyrosols and derivatives
Direct Parent tyrosols and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • secondary amine
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • tyrosol derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound
  • amine