Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:37 UTC
Update Date2025-03-25 00:57:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02223598
Frequency0.5
Structure
Chemical FormulaC10H12N2O2
Molecular Mass192.0899
SMILESN=C(N)c1ccc(CCC(=O)O)cc1
InChI KeyGVKRYYGUEGMHJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classphenylpropanoic acids
Subclass phenylpropanoic acids
Direct Parent phenylpropanoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amidines
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • amidine
  • carboximidamide
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound