Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:14 UTC
Update Date2025-03-25 00:51:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185865
Frequency0.5
Structure
Chemical FormulaC13H13NO3
Molecular Mass231.0895
SMILESO=C(CCc1ccco1)Nc1ccc(O)cc1
InChI KeyJDFOXTRPLSLRMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • fatty amide
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-arylamide
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • heteroaromatic compound
  • carboxamide group
  • anilide
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound