Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:11 UTC
Update Date2025-03-21 18:07:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00069773
Frequency43.2
Structure
Chemical FormulaC12H14O2
Molecular Mass190.0994
SMILESCc1cc2c(cc1C)C(C)(C)OC2=O
InChI KeyUOUDOUUVOVBREQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass benzofuranones
Direct Parent benzofuranones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • phthalides
  • Substituents
  • benzofuranone
  • carboxylic acid derivative
  • phthalide
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • isobenzofuranone
  • isocoumaran
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound