Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:49:43 UTC
Update Date2025-03-24 14:36:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00889809
Frequency1.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCOC1CCC(=O)C=C1O
InChI KeyISYKWDWDAUVYFX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • vinylogous acids
  • Substituents
  • cyclohexenone
  • ether
  • dialkyl ether
  • vinylogous acid
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative