Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:47 UTC
Update Date2025-03-25 00:55:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209992
Frequency0.5
Structure
Chemical FormulaC21H34O3
Molecular Mass334.2508
SMILESCC1(C)C(O)CCC2(C)C1CCC1C3CCC3(C(=O)O)CCC12C
InChI KeyZTVJZISHPGMWSJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic homopolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • secondary alcohol
  • hydrocarbon derivative