Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:10:50 UTC
Update Date2025-03-24 16:42:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00940441
Frequency1.5
Structure
Chemical FormulaC8H12O
Molecular Mass124.0888
SMILESC=CC(O)C1=CCCC1
InChI KeyNYGRFASZFWUCAJ-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