Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:18:04 UTC
Update Date2025-03-24 21:07:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01677361
Frequency0.7
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESCCOC(O)=C(C)C
InChI KeyQEINOOYHOLDWOU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass organooxygen compounds
Direct Parent organooxygen compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • hydrocarbon derivative
  • organooxygen compound