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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:49:13 UTC
Update Date2025-03-24 22:22:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01176321
Frequency1.2
Structure
Chemical FormulaC8H10O2
Molecular Mass138.0681
SMILESCc1coc(CC=O)c1C
InChI KeyKGPRLQKZVNMQNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha-hydrogen aldehydes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
    • Substituents
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • aldehyde
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • organooxygen compound