Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:39 UTC
Update Date2025-03-25 01:00:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241590
Frequency0.5
Structure
Chemical FormulaC3H8NO4PS
Molecular Mass184.9912
SMILESCC(N)C(=O)OP(O)(O)=S
InChI KeyCMOJPCIZEYNEPP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alanine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic thiophosphoric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • thiophosphate monoesters
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • thiophosphate monoester
  • organic thiophosphoric acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound