Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:30 UTC
Update Date2025-03-25 00:49:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175026
Frequency0.5
Structure
Chemical FormulaC13H22O2
Molecular Mass210.162
SMILESCCCCCC1=C(C)C(CC(=O)O)CC1
InChI KeyZVWGACNWVPLQLR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent iridoids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • Substituents
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 11-noriridane monoterpenoid
  • organooxygen compound