Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:21 UTC
Update Date2025-03-21 17:57:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006950
Frequency736.0
Structure
Chemical FormulaC8H10NO5P
Molecular Mass231.0297
SMILESNC(=O)Cc1ccc(OP(=O)(O)O)cc1
InChI KeyAGGOPIVSEGYGSS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phenyl phosphates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phenylacetamides
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • monocyclic benzene moiety
  • carbonyl group
  • phenyl phosphate
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • phenylacetamide
  • organooxygen compound