Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:46 UTC
Update Date2025-03-25 00:46:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152933
Frequency0.5
Structure
Chemical FormulaC7H16N3O7P
Molecular Mass285.0726
SMILESNC(=O)CCNC(=O)C(O)C(N)COP(=O)(O)O
InChI KeyKLCFFEWRRQQAFH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monoalkylamines
  • monosaccharides
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phosphoethanolamines
  • primary carboxylic acid amides
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • monosaccharide
  • phosphoethanolamine
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • alcohol
  • carboxamide group
  • n-acyl-amine
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound