Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:47 UTC
Update Date2025-03-21 18:40:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131309
Frequency19.3
Structure
Chemical FormulaC9H11O6P
Molecular Mass246.0293
SMILESCOP(=O)(O)Oc1ccc(CC(=O)O)cc1
InChI KeyZDEMVPKDLKBSAJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenoxy compounds
Direct Parent phenoxy compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • phenoxy compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound