Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:35:25 UTC
Update Date2025-03-21 18:46:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00146620
Frequency16.7
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESC=C1C=CC(=O)C(C)(C)C1
InChI KeyCRPQUISNMCRISW-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
  • Substituents
  • cyclohexenone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative