Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:41 UTC
Update Date2025-03-25 00:54:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207367
Frequency0.5
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=C1CCC(C)(O)C(C)C1
InChI KeyZYYVLLRWSKOJSA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol