Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:49 UTC
Update Date2025-03-25 00:48:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168898
Frequency0.5
Structure
Chemical FormulaC11H14O2
Molecular Mass178.0994
SMILESCC(C)CC(=O)C=Cc1ccco1
InChI KeyARPBBWPSIYPLJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acryloyl compounds
  • enones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alpha,beta-unsaturated ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • acryloyl-group
  • organooxygen compound
  • enone