Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:45:39 UTC
Update Date2025-03-21 18:00:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00028171
Frequency134.0
Structure
Chemical FormulaC14H11NO2
Molecular Mass225.079
SMILESO=C(O)Cc1c[nH]c2cc3ccccc3cc12
InChI KeyWCXGCHXTGONBGP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • indole
  • heteroaromatic compound
  • indole or derivatives
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound