Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:02:23 UTC
Update Date2025-03-24 21:27:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01782829
Frequency0.7
Structure
Chemical FormulaC5H5NO3
Molecular Mass127.0269
SMILESNc1ccoc(=O)c1O
InChI KeyZXNRLHUBPBVITM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyranones and derivatives
Direct Parent pyranones and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • pyranone
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound