Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:29:23 UTC
Update Date2025-03-21 19:19:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00272314
Frequency7.5
Structure
Chemical FormulaC9H18O
Molecular Mass142.1358
SMILESCCC=CC(O)C(C)CC
InChI KeyVHWUAIZWORESDS-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