Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:22:03 UTC
Update Date2025-03-25 01:24:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02389971
Frequency0.5
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC1(O)CC2C=CCC1O2
InChI KeyDMECZFDBIWYYKS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • tertiary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • tetrahydrofuran
  • monosaccharide
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • tertiary alcohol
  • saccharide
  • organic oxygen compound
  • pyran
  • hydrocarbon derivative
  • organooxygen compound