Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:19 UTC
Update Date2025-03-25 00:54:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208888
Frequency0.5
Structure
Chemical FormulaC10H14O4
Molecular Mass198.0892
SMILESCC(C)C1(O)CC(=O)C=C(C(=O)O)C1
InChI KeyFVCIUKJDROAAEN-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
  • carboxylic acids
  • cyclohexenones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound