Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:27:26 UTC
Update Date2025-03-21 19:17:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00267619
Frequency7.7
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCCCC(=C=O)CCO
InChI KeyJEVQQEFSCKQICL-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
  • alcohols and polyols
  • hydrocarbon derivatives
  • ketenes
  • organic oxides
  • ynolates
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • ynolate
  • fatty alcohol
  • hydrocarbon derivative
  • ketene
  • organooxygen compound