Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:17:04 UTC
Update Date2025-03-21 20:52:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00383093
Frequency4.8
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESO=C(CO)Cc1ccco1
InChI KeyCWAPLHJUUXVEAV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-hydroxy ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • alcohol
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alpha-hydroxy ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound