Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:27 UTC
Update Date2025-03-25 01:00:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245849
Frequency0.5
Structure
Chemical FormulaC12H20O2
Molecular Mass196.1463
SMILESCC1=CCCC(C)(C)C1C(C)(O)C=O
InChI KeyLWZUXBBFCFFAKL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monocyclic monoterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alpha-hydroxyaldehydes
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • monocyclic monoterpenoid
  • aldehyde
  • tertiary alcohol
  • organic oxide
  • alpha-hydroxyaldehyde
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound