Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:43 UTC
Update Date2025-03-21 18:41:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133435
Frequency18.9
Structure
Chemical FormulaC15H22O5
Molecular Mass282.1467
SMILESCC1C(Oc2ccccc2O)OC(C(O)O)C(C)C1C
InChI KeyAGAYHFUGOOUBOE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • carbonyl hydrates
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl hydrate
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • acetal
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound