Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:50 UTC
Update Date2025-03-25 00:50:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180416
Frequency0.5
Structure
Chemical FormulaC14H20O4
Molecular Mass252.1362
SMILESOc1cccc(C(O)C(O)C2CCC(O)CC2)c1
InChI KeyGDBBUFCJARMGMD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aromatic alcohols
  • benzene and substituted derivatives
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • aromatic alcohol
  • monocyclic benzene moiety
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • cyclic alcohol
  • aromatic homomonocyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid