Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:35 UTC
Update Date2025-03-25 01:00:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246164
Frequency0.5
Structure
Chemical FormulaC15H22O3
Molecular Mass250.1569
SMILESCC12CCC3C(CC(=O)O)CCC3C1CCC2=O
InChI KeyGYGRTPYCLJSTCG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • hydrocarbon derivative
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound