Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:11:56 UTC
Update Date2025-03-21 18:32:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090599
Frequency31.1
Structure
Chemical FormulaC10H16O5
Molecular Mass216.0998
SMILESCC(C)=C1CC(O)(C(=O)O)CC(O)C1O
InChI KeyVFOAFXCKCUEZKC-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 hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • alpha-hydroxy acid
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound