Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:44 UTC
Update Date2025-03-25 00:51:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187042
Frequency0.5
Structure
Chemical FormulaC17H22O4
Molecular Mass290.1518
SMILESCC(C(=O)O)c1ccc2c(c1)CCC(C)(CCC(=O)O)C2
InChI KeyQGDIVDKTYCJWHT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • tetralin
  • carbonyl group
  • organic oxide
  • carboxylic acid
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound