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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:57 UTC
Update Date2025-03-25 00:51:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187561
Frequency0.5
Structure
Chemical FormulaC11H18O7
Molecular Mass262.1053
SMILESCC(C)=CC(=O)OC1C(O)C(O)OC(CO)C1O
InChI KeyAFVXTHGSGIMXOJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsaccharolipids
Subclass saccharolipids
Direct Parent saccharolipids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • enoate esters
  • fatty acid esters
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • enoate ester
  • alcohol
  • fatty acyl
  • carbonyl group
  • monosaccharide
  • carboxylic acid derivative
  • oxacycle
  • alpha,beta-unsaturated carboxylic ester
  • fatty acid ester
  • saccharide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • saccharolipid
  • organoheterocyclic compound
  • organooxygen compound