Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:58 UTC
Update Date2025-03-25 00:58:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230915
Frequency0.5
Structure
Chemical FormulaC22H42O4
Molecular Mass370.3083
SMILESCCCCCCCCCCCCCCCC(=O)OC1CCCC(O)C1O
InChI KeyNWMQWZNDQAYMKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • carboxylic acid esters
  • cyclitols and derivatives
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • carbonyl group
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid ester
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol