Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:21 UTC
Update Date2025-03-25 00:50:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181603
Frequency0.5
Structure
Chemical FormulaC9H17NO2
Molecular Mass171.1259
SMILESO=C(O)CCCCNCC1CC1
InChI KeyKYJNFNXRKOKXIJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent delta amino acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • amino acids
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • fatty acyl
  • carbocyclic fatty acid
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • amino acid
  • fatty acid
  • secondary amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • delta amino acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine