Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:24 UTC
Update Date2025-03-25 00:48:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02170188
Frequency0.5
Structure
Chemical FormulaC15H25NO11
Molecular Mass395.1428
SMILESCC(=O)NC1C(O)CC(C(=O)O)C(O)C1OC(C(O)CO)C(O)C(O)C=O
InChI KeyDBPMEXWVHCDKLJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • alpha-hydroxyaldehydes
  • beta hydroxy acids and derivatives
  • beta-hydroxy aldehydes
  • carboxylic acids
  • cyclitols and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • beta-hydroxy aldehyde
  • carbonyl group
  • ether
  • carboxylic acid
  • monosaccharide
  • carboxylic acid derivative
  • dialkyl ether
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • acetamide
  • cyclohexanol
  • aldehyde
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organic nitrogen compound