Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:47 UTC
Update Date2025-03-21 18:28:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00071202
Frequency42.2
Structure
Chemical FormulaC9H20O
Molecular Mass144.1514
SMILESCCC(O)(CC)CC(C)C
InChI KeyRMBUNHOAKTUXTC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative