Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:43 UTC
Update Date2025-03-25 00:46:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155205
Frequency0.5
Structure
Chemical FormulaC12H12O3
Molecular Mass204.0786
SMILESCc1cc2c(cc1C)C(=O)C(C)(C=O)O2
InChI KeyYHGVANKNWKPHGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass benzofuranones
Direct Parent benzofuranones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aldehydes
  • alkyl aryl ethers
  • aryl alkyl ketones
  • benzenoids
  • coumarans
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • aryl alkyl ketone
  • benzofuranone
  • aldehyde
  • alkyl aryl ether
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • coumaran
  • organooxygen compound
  • aryl ketone