Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:15:25 UTC
Update Date2025-03-21 19:08:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00239980
Frequency8.8
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESO=C(CO)C1(O)CCCC1
InChI KeyFEGIAVXEPBYXKI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • tertiary alcohols
  • Substituents
  • ketone
  • carbonyl group
  • tertiary alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol
  • cyclopentanol