Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:27:45 UTC
Update Date2025-03-21 23:17:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00692861
Frequency2.2
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCN1CC=C(C(N)=O)CC1
InChI KeyOZKAFNMISLVYEO-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 heteromonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • azacycle
  • amino acid or derivatives
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound