Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:07 UTC
Update Date2025-03-25 00:49:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176490
Frequency0.5
Structure
Chemical FormulaC29H44O2
Molecular Mass424.3341
SMILESCCCCCCCCCCCCCCCCCCOC(=O)c1ccc2ccccc2c1
InChI KeyPKPFMXFNPRKTCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenecarboxylic acids and derivatives
Direct Parent naphthalenecarboxylic acids
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • aromatic homopolycyclic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • 2-naphthalenecarboxylic acid
  • organooxygen compound