Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:25:01 UTC
Update Date2025-03-24 21:10:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01694403
Frequency0.7
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESCC=C(C)NC=O
InChI KeyXSNGZJFMBIKBNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent secondary 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
  • aliphatic acyclic compound
  • carbonyl group
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound