Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:50 UTC
Update Date2025-03-21 17:57:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00005772
Frequency915.1
Structure
Chemical FormulaC11H15NO2
Molecular Mass193.1103
SMILESCN(C)C(Cc1ccccc1)C(=O)O
InChI KeyHOGIQTACRLIOHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent phenylalanine and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • amphetamines and derivatives
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • phenylpropanoic acids
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • amino acid
  • organic oxide
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • amphetamine or derivatives
  • tertiary aliphatic amine
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • phenylalanine or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound