Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:15 UTC
Update Date2025-03-25 00:53:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02201818
Frequency0.5
Structure
Chemical FormulaC19H28O2
Molecular Mass288.2089
SMILESCc1cc2c(c(C)c1C)CCC2(C)CCCC(C)C(=O)O
InChI KeyPYJLNGOQNOZKNT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • medium-chain fatty acids
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • fatty acid
  • aromatic homopolycyclic compound
  • carboxylic acid derivative
  • branched fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • indane
  • hydrocarbon derivative
  • medium-chain fatty acid
  • organooxygen compound