Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:39 UTC
Update Date2025-03-21 18:35:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107072
Frequency25.1
Structure
Chemical FormulaC3H10NO4PS
Molecular Mass187.0068
SMILESNC(CS)COP(=O)(O)O
InChI KeyWBPGJXUMZFPCCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phosphoethanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organosulfur compound
  • phosphoethanolamine
  • organic oxide
  • organic oxygen compound
  • monoalkyl phosphate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol
  • alkyl phosphate
  • organooxygen compound