Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:34 UTC
Update Date2025-03-25 00:57:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227853
Frequency0.5
Structure
Chemical FormulaC7H10O
Molecular Mass110.0732
SMILESC=C=C=CC(O)CC
InChI KeyFUWHBTWDLXDZDH-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