Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:03 UTC
Update Date2025-03-25 00:52:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194449
Frequency0.5
Structure
Chemical FormulaC16H27NO3
Molecular Mass281.1991
SMILESCCCCCCCCCc1ccc(CC(N)C(=O)O)o1
InChI KeyPAGDVCTYRSYLBV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent furanoid fatty acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • furan
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • furanoid fatty acid