Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:56:07 UTC
Update Date2025-03-21 22:01:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00475991
Frequency3.6
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESCC(O)C1CC(O)CC1=O
InChI KeyFHWYUGCIDUUUJJ-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
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • cyclopentanol
  • ketone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative