Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:18:08 UTC
Update Date2025-03-21 23:13:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00669915
Frequency2.3
Structure
Chemical FormulaC6H7NO3
Molecular Mass141.0426
SMILESCOC(=O)Cc1cnco1
InChI KeyQWPYQWDTANDQNS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • oxazole
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound