Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:14:10 UTC
Update Date2025-03-24 20:40:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01524199
Frequency0.8
Structure
Chemical FormulaC6H7NO3
Molecular Mass141.0426
SMILESO=C(CO)Cc1cnco1
InChI KeyDFIYEKDWKDDUCM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-hydroxy ketones
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • alcohol
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • oxazole
  • alpha-hydroxy ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound