Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:34:17 UTC
Update Date2025-03-25 01:06:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02279741
Frequency0.5
Structure
Chemical FormulaC7H12O
Molecular Mass112.0888
SMILESCCC1=CC(O)CC1
InChI KeyPRZRXKYPWUUEFP-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