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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:49:33 UTC
Update Date2025-03-21 18:02:20 UTC
HMDB IDHMDB0003831
Metabolite Identification
DeepMet IDDMID00037520
NameBeta-Tyrosine
Frequency93.8
Structure
Chemical FormulaC9H11NO3
Molecular Mass181.0739
SMILESNC(CC(=O)O)c1ccc(O)cc1
InChI KeyJYPHNHPXFNEZBR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenylpropanoic acids
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • beta amino acid or derivatives
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound