Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:58:01 UTC
Update Date2025-03-24 20:06:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01342734
Frequency1.0
Structure
Chemical FormulaC9H18O
Molecular Mass142.1358
SMILESCC=CC(O)C(C)(C)CC
InChI KeyWHCNDLDTWRYHOX-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