Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:23 UTC
Update Date2025-03-25 00:45:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152009
Frequency0.5
Structure
Chemical FormulaC9H16NO3+
Molecular Mass186.1125
SMILESC=CCCCCCC[N+](=O)C(=O)O
InChI KeyXSFQLQRHLUWDQA-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass organic carbonic acids and derivatives
Direct Parent organic carbonic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carbonic acid derivative
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium
  • organooxygen compound