Hmdb loader

Showing information for DMID02240416

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:08 UTC
Update Date2025-03-25 00:59:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240416
Frequency0.5
Structure
Chemical FormulaC11H13NO5
Molecular Mass239.0794
SMILESO=C1OC(Cc2cccnc2)C(O)C(O)C1O
InChI KeyVCLFYAQQVZLNMY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent gluconolactones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • delta valerolactones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
    • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • delta valerolactone
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • gluconolactone
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • delta_valerolactone
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyridine
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound