Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:36 UTC
Update Date2025-03-25 00:55:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214306
Frequency0.5
Structure
Chemical FormulaC11H15O6P
Molecular Mass274.0606
SMILESCCOC(=O)c1ccccc1OP(=O)(O)OCC
InChI KeySNTZGQMOFCJGHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acid esters
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzoyl derivatives
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • phenoxy compounds
  • Substituents
  • benzoyl
  • benzoate ester
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • hydrocarbon derivative
  • phenoxy compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound