Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:35:20 UTC
Update Date2025-03-21 21:52:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00427160
Frequency4.2
Structure
Chemical FormulaC7H10O2
Molecular Mass126.0681
SMILESCC1CC(=O)C=C(O)C1
InChI KeyMNOUUYHZNVGKSQ-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
  • vinylogous acids
  • Substituents
  • cyclohexenone
  • vinylogous acid
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative