Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:53:48 UTC
Update Date2025-03-21 18:03:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00047704
Frequency69.7
Structure
Chemical FormulaC7H13NO6
Molecular Mass207.0743
SMILESNC1C(O)C(=O)OC1C(O)C(O)CO
InChI KeyBEJFVISNJRKXIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • tetrahydrofuran
  • monosaccharide
  • carboxylic acid derivative
  • gamma butyrolactone
  • oxacycle
  • saccharide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound