Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:29 UTC
Update Date2025-03-25 01:00:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245910
Frequency0.5
Structure
Chemical FormulaC17H31O17P
Molecular Mass538.1299
SMILESCC1OC(OCC2OC(OC(C(O)C=O)C(O)COP(=O)(O)O)C(O)C(O)C2O)C(O)C(O)C1O
InChI KeyIRSKNFCBGNJRLN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent pentose phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alpha-hydroxyaldehydes
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • pentose phosphate
  • aldehyde
  • oxacycle
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • phosphoric acid ester
  • monoalkyl phosphate
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organoheterocyclic compound