Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:45:06 UTC
Update Date2025-03-21 18:49:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00169602
Frequency13.8
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESC=CC1(O)C=C(C)CCC1
InChI KeyVETXXJZMVVPTTA-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