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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:27:26 UTC
Update Date2025-03-24 22:04:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01984546
Frequency0.6
Structure
Chemical FormulaC42H72N2O32
Molecular Mass1116.4068
SMILESCC(=O)NC1CC(OC2OC(C)C(O)C(O)C2O)(OC2OC(CO)C(O)C(O)C2O)C(CO)OC1OC1C(O)C(CO)OC(OC2OC(CO)C(O)C(OC3OC(C(O)C(O)CO)C(NC(C)=O)C(O)C3O)C2O)C1O
InChI KeyFIHAWCSQZKGHTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • alcohol
  • carbonyl group
  • monosaccharide
  • carboxamide group
  • carboxylic acid derivative
  • oxacycle
  • secondary carboxylic acid amide
  • saccharide
  • organic oxide
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • acetamide