Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:42:23 UTC
Update Date2025-03-24 17:56:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01016083
Frequency1.4
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESC=CC1(O)C=CCC(C)=C1
InChI KeyDPSODMOACGSYGN-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