Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:14 UTC
Update Date2025-03-25 00:46:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158528
Frequency0.5
Structure
Chemical FormulaC18H32O16
Molecular Mass504.169
SMILESOCC1OC(OC2(OC3C(O)C(O)C(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
InChI KeyZQZVENYAUMFXHO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • carboxylic acid orthoesters
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • ortho esters
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • tetrahydrofurans
  • Substituents
  • ortho ester
  • tetrahydrofuran
  • cyclohexanol
  • monosaccharide
  • cyclitol or derivatives
  • carboxylic acid orthoester
  • cyclic alcohol
  • oxacycle
  • saccharide
  • acetal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • orthocarboxylic acid derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound