Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:58 UTC
Update Date2025-03-21 18:02:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00036057
Frequency98.3
Structure
Chemical FormulaC7H12O
Molecular Mass112.0888
SMILESCC1C=CC(O)CC1
InChI KeyYOQLXQKRNWMILQ-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
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative