Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:37 UTC
Update Date2025-03-25 00:51:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02184421
Frequency0.5
Structure
Chemical FormulaC12H14N2O3
Molecular Mass234.1004
SMILESNC(Cc1c[nH]c2ccccc12)C(=O)C(O)O
InChI KeyTVSUEMFFVHKZPX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • azacyclic compounds
  • benzenoids
  • carbonyl hydrates
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • carbonyl group
  • carbonyl hydrate
  • azacycle
  • indole
  • heteroaromatic compound
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • saccharide
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound