Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:46 UTC
Update Date2025-03-25 01:00:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241898
Frequency0.5
Structure
Chemical FormulaC9H17NO3
Molecular Mass187.1208
SMILESCC(C)CC(NC=O)C(=O)C(C)O
InChI KeyCAKUULKWTXVNIL-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
  • acyloins
  • alpha-hydroxy ketones
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • monosaccharide
  • carboxamide group
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • secondary carboxylic acid amide
  • organic oxide
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound