Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:27 UTC
Update Date2025-03-21 18:38:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121055
Frequency21.4
Structure
Chemical FormulaC10H20NO+
Molecular Mass170.1539
SMILESCCCCC=CC(=O)[N+](C)(C)C
InChI KeyANTVBBANBHOVQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids and derivatives
Direct Parent carboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • carboxylic acid derivative
  • organooxygen compound