Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:17:27 UTC
Update Date2025-03-24 14:15:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00812233
Frequency1.8
Structure
Chemical FormulaC8H10O2
Molecular Mass138.0681
SMILESCC(C)c1coccc1=O
InChI KeyIKVZUMZRZSYDAR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyranones and derivatives
Direct Parent pyranones and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • pyranone
  • hydrocarbon derivative
  • cyclic ketone
  • organooxygen compound