Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:09 UTC
Update Date2025-03-25 00:52:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196947
Frequency0.5
Structure
Chemical FormulaC10H19NO2
Molecular Mass185.1416
SMILESCCC=CCCC(N)COC(C)=O
InChI KeyOQRWJPBUOAVQNB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound