Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:20 UTC
Update Date2025-03-25 00:56:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215955
Frequency0.5
Structure
Chemical FormulaC9H19NO5
Molecular Mass221.1263
SMILESCCCCC(O)C(O)=NOCC(O)CO
InChI KeyQQLPCKJUTDOIGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol