Hmdb loader

Showing information for DMID02176875

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:17 UTC
Update Date2025-03-25 00:49:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176875
Frequency0.5
Structure
Chemical FormulaC12H16O3
Molecular Mass208.1099
SMILESCCCCCc1cc(O)cc(O)c1C=O
InChI KeyFFMCYBHCUWCBLJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent hydroxybenzaldehydes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • resorcinols
  • vinylogous acids
    • Substituents
  • monocyclic benzene moiety
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • hydroxybenzaldehyde