Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:28 UTC
Update Date2025-03-21 18:36:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111496
Frequency23.8
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1(O)C=CCC(C)(C)C1
InChI KeyYGBNHNGYSRNOKG-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
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative