Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:07 UTC
Update Date2025-03-25 00:55:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02210813
Frequency0.5
Structure
Chemical FormulaC12H21N3O6
Molecular Mass303.143
SMILESC=CCN(CCC(=O)O)C(=N)NC1OC(CO)C(O)C1O
InChI KeyUJCSIDLOJXUJBY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • guanidine
  • imine
  • monosaccharide
  • carboximidamide
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organoheterocyclic compound