Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:16 UTC
Update Date2025-03-21 18:40:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00130055
Frequency19.5
Structure
Chemical FormulaC7H15NO2
Molecular Mass145.1103
SMILESCNC(CC(=O)O)C(C)C
InChI KeyCXLPKVYJLITGLF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • amino acid
  • fatty acid
  • secondary amine
  • branched fatty acid
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine