Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:27 UTC
Update Date2025-03-25 00:54:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209193
Frequency0.5
Structure
Chemical FormulaC17H28O5
Molecular Mass312.1937
SMILESCC12CC(O)C3CC(O)CCC3C1CCC2(O)CCC(=O)O
InChI KeyMBOOBOOBKDFOFH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • secondary alcohol
  • hydrocarbon derivative