Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:09:39 UTC
Update Date2025-03-21 20:48:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00365878
Frequency5.1
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC1(C)CC(O)CC1=O
InChI KeyUDWPJUGSEKDJPB-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