Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:44:27 UTC
Update Date2025-03-24 20:27:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01452836
Frequency0.9
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESC=CC=CCC(O)C(C)=O
InChI KeyGGYVEINZXVYZAZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty alcohols
Direct Parent fatty alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyloins
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • organic oxygen compound
  • fatty alcohol
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound