Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:22 UTC
Update Date2025-03-25 00:56:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220735
Frequency0.5
Structure
Chemical FormulaC21H27NO2
Molecular Mass325.2042
SMILESO=C(O)CCCCCCCCc1ccc(Nc2ccccc2)cc1
InChI KeyVPCIIAPTNOONEZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent carbocyclic fatty acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amino acids
  • amino fatty acids
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • medium-chain fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary amines
  • Substituents
  • carbocyclic fatty acid
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • secondary amine
  • carboxylic acid derivative
  • amino fatty acid
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine