Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:42 UTC
Update Date2025-03-21 18:35:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107174
Frequency25.1
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESOc1cc(O)c2c(c1)CCC(O)C2
InChI KeyBNJGLYHKQFIJNT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • alcohol
  • tetralin
  • organic oxygen compound
  • secondary alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound