Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:20 UTC
Update Date2025-03-25 00:45:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151922
Frequency0.5
Structure
Chemical FormulaC26H45NO4
Molecular Mass435.3349
SMILESNC(CCCCCCCCCCCCCCCCCCc1cc(O)cc(O)c1)C(=O)O
InChI KeyVSQVCAZFUNVFQD-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 aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alpha amino acids
  • amino fatty acids
  • benzene and substituted derivatives
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • resorcinols
  • Substituents
  • carbocyclic fatty acid
  • monocyclic benzene moiety
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • resorcinol
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • 1-hydroxy-4-unsubstituted benzenoid
  • amino fatty acid
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound