Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:00:21 UTC
Update Date2025-03-21 18:06:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00062958
Frequency49.1
Structure
Chemical FormulaC9H12O2
Molecular Mass152.0837
SMILESCC(=O)CCCc1ccco1
InChI KeyKTJPAMPVINHYGX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • ketone
  • furan
  • oxacycle
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • organooxygen compound