Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:37 UTC
Update Date2025-03-21 18:34:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00099554
Frequency27.6
Structure
Chemical FormulaC20H43O23P5
Molecular Mass806.0883
SMILESCCCCCCCCCCCC(O)CC(=O)OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O
InChI KeyRYDRNJNGHFIQCY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent inositol phosphates
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • fatty acyl
  • carbonyl group
  • hydroxy acid
  • inositol phosphate
  • carboxylic acid derivative
  • fatty acid ester
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate