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CHEBI:183843 - alpha-Nicotinamide mononucleotide

Default Structure
ChEBI IDCHEBI:183843
ChEBI Namealpha-Nicotinamide mononucleotide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H15N2O8P
Net Charge0
Average Mass334.221
Monoisotopic Mass334.05660
SMILESNC(=O)c1ccc[n+]([C@H]2O[C@H](COP(=O)([O-])O)[C@@H](O)[C@H]2O)c1
InChIInChI=1S/C11H15N2O8P/c12-10(16)6-2-1-3-13(4-6)11-9(15)8(14)7(21-11)5-20-22(17,18)19/h1-4,7-9,11,14-15H,5H2,(H3-,12,16,17,18,19)/t7-,8-,9-,11+/m1/s1
InChIKeyDAYLJWODMCOQEW-CDLYGTGVSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3487) Strain: C57BL [EFO:0005181]
ChEBI Ontology
Outgoing Relation(s)
alpha-Nicotinamide mononucleotide (CHEBI:183843) is a nicotinamide nucleotide (CHEBI:25527)
IUPAC Name 
[(2R,3S,4R,5S)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
Manual XrefsDatabases
29361826ChemSpider