Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:23 UTC
Update Date2025-03-25 01:01:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02247979
Frequency0.5
Structure
Chemical FormulaC9H11N3O2
Molecular Mass193.0851
SMILESN=C(CC(N)=O)c1cccc(O)c1N
InChI KeyUTRBPXJGRQKKNW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • amino acids and derivatives
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • carbonyl group
  • monocyclic benzene moiety
  • amino acid or derivatives
  • fatty amide
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound