Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:39 UTC
Update Date2025-03-25 00:46:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155023
Frequency0.5
Structure
Chemical FormulaC14H20O7
Molecular Mass300.1209
SMILESCc1ccc(C)c(OC2OC(C(O)O)C(O)C(O)C2O)c1
InChI KeySKZGDSTUAIIKOQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • carbonyl hydrates
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • secondary alcohols
  • p-xylenes
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl hydrate
  • aromatic heteromonocyclic compound
  • monosaccharide
  • xylene
  • oxacycle
  • saccharide
  • p-xylene
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound