Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:55 UTC
Update Date2025-03-25 00:45:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150956
Frequency0.5
Structure
Chemical FormulaC10H19NO2
Molecular Mass185.1416
SMILESC=CCCCCC(O)C(=O)CNC
InChI KeyJTTVZDVPVPMTSV-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
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • monosaccharide
  • secondary amine
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine