Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:32 UTC
Update Date2025-03-25 00:48:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02170493
Frequency0.5
Structure
Chemical FormulaC25H49O11P
Molecular Mass556.3012
SMILESCCCCCCCCCCCCCCCCCC(=O)OCOC1C(O)C(O)C(OP(=O)(O)O)C(O)C1O
InChI KeyNKGHQQKSDNSPMN-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
  • acetals
  • carbonyl compounds
  • carboxylic acid esters
  • cyclohexanols
  • fatty acid esters
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • carbonyl group
  • cyclohexanol
  • inositol phosphate
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • acetal
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate