Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:53 UTC
Update Date2025-03-25 00:56:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219601
Frequency0.5
Structure
Chemical FormulaC10H14O4
Molecular Mass198.0892
SMILESCOc1ccc(C(O)C(C)(O)O)cc1
InChI KeyRURLONROSKMPCW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • aromatic alcohols
  • carbonyl hydrates
  • hydrocarbon derivatives
  • methoxybenzenes
  • phenoxy compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • phenol ether
  • ether
  • carbonyl hydrate
  • alkyl aryl ether
  • methoxybenzene
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound