Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:23:16 UTC
Update Date2025-03-24 20:18:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01402626
Frequency0.9
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1=CC(CO)CC(C)C1
InChI KeyNQNLYPMYXBEBTL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent primary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol