Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:10:44 UTC
Update Date2025-03-24 16:42:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00940234
Frequency1.5
Structure
Chemical FormulaC8H12O
Molecular Mass124.0888
SMILESC=CCC(C=O)=C(C)C
InChI KeyYDZDMKKPECNBPE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbon derivatives
ClassNot Available
Subclass hydrocarbon derivatives
Direct Parent hydrocarbon derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • aldehyde
  • hydrocarbon derivative
  • organooxygen compound