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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:39:51 UTC
Update Date2025-03-21 17:58:33 UTC
HMDB IDHMDB0011727
Metabolite Identification
DeepMet IDDMID00015092
NameBicine
Frequency289.5
Structure
Chemical FormulaC6H13NO4
Molecular Mass163.0845
SMILESO=C(O)CN(CCO)CCO
InChI KeyFSVCELGFZIQNCK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • alcohols and polyols
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • 1,2-aminoalcohol
  • amino acid
  • tertiary aliphatic amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound
  • alkanolamine