Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:16:42 UTC
Update Date2025-03-24 20:41:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01530284
Frequency0.8
Structure
Chemical FormulaC9H20O
Molecular Mass144.1514
SMILESCCC(C)(C(C)C)C(C)O
InChI KeyZKCLEGGKXQGTIW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative