Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:04 UTC
Update Date2025-03-21 18:39:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00127187
Frequency20.1
Structure
Chemical FormulaC8H12O3
Molecular Mass156.0786
SMILESO=C(O)C1(O)CC2CCC1C2
InChI KeyNLJMUWHNMKOGBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent bicyclic monoterpenoids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • bicyclic monoterpenoid
  • organooxygen compound