Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:43:25 UTC
Update Date2025-03-24 14:33:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00874523
Frequency1.7
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESC=CC(C=C(C)C)C(N)=O
InChI KeyKKDRJXDVYSKPBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent primary carboxylic acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound