Met000413: Choline
Metabolite Information
Name
Choline
IUPAC Name
2-hydroxyethyl(trimethyl)azanium
Molecular Formula
C5H14NO+
Molecular Weight
104.17
Exact Mass
104.1075391
SMILES
C[N+](C)(C)CCO
InChIKey
OEYIOHPDSNJKLS-UHFFFAOYSA-N
InChI
InChI=1S/C5H14NO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organic nitrogen compounds
Class:
Organonitrogen compounds
Subclass:
Quaternary ammonium salts
Crops containing this metabolite
astragalus
medicago
rice
sweet_potato
sugar_maple
medicago
rice
sweet_potato
sugar_maple
Metabolite Spectrum Accession Label