Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:38 UTC
Update Date2025-03-25 00:45:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150269
Frequency0.5
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESOC(O)=CCC(O)c1ccccc1
InChI KeyIDAQBIOCBONSII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound