Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:48 UTC
Update Date2025-03-25 00:45:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150662
Frequency0.5
Structure
Chemical FormulaC25H40O9
Molecular Mass484.2672
SMILESCC12CCC(OC3OC(CO)C(O)C(O)C3O)C(O)C1CCC1CC(O)C2C2(C)C(=O)CCC12
InChI KeyYLOUYJQKCZRHJR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • monosaccharide
  • cyclic alcohol
  • ketone
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound