Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:35 UTC
Update Date2025-03-25 00:54:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209523
Frequency0.5
Structure
Chemical FormulaC16H20O2
Molecular Mass244.1463
SMILESCC1=C(CCC(=O)O)CCc2c(C)cc(C)cc21
InChI KeyQFMXSPIFLAEHIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • naphthalene
  • carboxylic acid
  • organic oxygen compound
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound