Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:29 UTC
Update Date2025-03-21 18:41:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00132910
Frequency19.0
Structure
Chemical FormulaC18H28O5
Molecular Mass324.1937
SMILESCOCCc1ccc(OC2OC(C(O)O)C(C)C(C)C2C)cc1
InChI KeyKQSQFVCFXHFDBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass tyrosols and derivatives
Direct Parent tyrosols and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • carbonyl hydrates
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • carbonyl hydrate
  • aromatic heteromonocyclic compound
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • acetal
  • hydrocarbon derivative
  • tyrosol derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound