Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:04 UTC
Update Date2025-03-25 00:50:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180981
Frequency0.5
Structure
Chemical FormulaC18H25NO5
Molecular Mass335.1733
SMILESO=C(O)CCC=CCC=CCC=CCC=CCC(O)=NCC(=O)O
InChI KeyQTTSHJSXHLDOPX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent long-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • amino fatty acids
  • carbonyl compounds
  • carboximidic acids
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • organic 1,3-dipolar compound
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • amino fatty acid
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organic nitrogen compound
  • organooxygen compound