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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:44:23 UTC
Update Date2025-03-24 14:02:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00733148
Frequency2.1
Structure
Chemical FormulaC7H10O
Molecular Mass110.0732
SMILESC=CCC=CCC=O
InChI KeyGUNATYGWSCXDCC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent medium-chain aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydrogen aldehydes
  • hydrocarbon derivatives
  • organic oxides
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • medium-chain aldehyde