Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:00 UTC
Update Date2025-03-21 18:04:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00050517
Frequency65.0
Structure
Chemical FormulaC12H22O
Molecular Mass182.1671
SMILESCCCCCCC1(O)C=CCCC1
InChI KeyGUDHCJFFDFLNHE-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