Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:24:24 UTC
Update Date2025-03-24 20:44:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01549052
Frequency0.8
Structure
Chemical FormulaC5H10O3
Molecular Mass118.063
SMILESCOC1CC(O)C1O
InChI KeyRGLRENHKOZIHDN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • dialkyl ethers
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • ether
  • cyclobutanol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • 1,2-diol