Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:36 UTC
Update Date2025-03-25 00:46:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157146
Frequency0.5
Structure
Chemical FormulaC7H11NO6
Molecular Mass205.0586
SMILESO=C=C(O)NCC(O)C(O)C(O)C=O
InChI KeyLRGYTXRQPMSMJR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • ynolates
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • beta-hydroxy aldehyde
  • carbonyl group
  • monosaccharide
  • aldehyde
  • secondary amine
  • organic oxide
  • alpha-hydroxyaldehyde
  • ynolate
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • alkanolamine