Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:01:34 UTC
Update Date2025-03-21 20:11:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00346632
Frequency5.5
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESCc1occc(=O)c1CO
InChI KeyIQZIFVIJHWDPFC-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
  • aromatic alcohols
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • cyclic ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • pyranone
  • hydrocarbon derivative
  • organooxygen compound