Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:06:28 UTC
Update Date2025-03-24 21:02:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01649386
Frequency0.8
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCCC(O)CC(C)=CO
InChI KeyYNWUDUPOIBQLIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative