Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:16 UTC
Update Date2025-03-21 18:39:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125269
Frequency20.5
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=C1CCC(C(C)(C)O)C1
InChI KeyOZKKDCWXHPDHQC-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