Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:01:58 UTC
Update Date2025-03-25 01:40:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02483888
Frequency0.5
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCOC=CC=CC(=O)O
InChI KeyVYDZEUFYICKPFY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass short-chain hydroxy acids and derivatives
Direct Parent short-chain hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • straight chain fatty acids
  • unsaturated fatty acids
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • carboxylic acid derivative
  • unsaturated fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound