Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:08:45 UTC
Update Date2025-03-21 19:05:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00224551
Frequency9.6
Structure
Chemical FormulaC7H10O2
Molecular Mass126.0681
SMILESCC1C=CC(=O)C(O)C1
InChI KeyAVCHNBQSFXBHPQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative