Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:01:10 UTC
Update Date2025-03-24 19:51:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01060374
Frequency1.3
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC1CC=CC(=O)CC1O
InChI KeyYBKZAWKNKRNBOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • ketone
  • carbonyl group
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic ketone