Hmdb loader

Showing information for DMID00113039

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:07 UTC
Update Date2025-03-21 18:36:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113039
Frequency23.4
Structure
Chemical FormulaC16H30N2O10
Molecular Mass410.19
SMILESCC(=O)NC1CC(O)C(NC(C)=O)C(C(O)C(O)CO)OC1C(O)C(O)CO
InChI KeyWYVVIJFYKFNUNQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • alcohol
  • carbonyl group
  • ether
  • carboxamide group
  • carboxylic acid derivative
  • dialkyl ether
  • oxepane
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • acetamide
  • organooxygen compound