chempirical

Nicotinamide riboside

C11H15N2O5+CAS 1341-23-7255.25 g/mol

Open in Covalent MOL file
H2NON+OOHOHHO
AlcoholEther

Properties

Molecular formula
C11H15N2O5+
Molar mass
255.25 g/mol
Exact mass
255.0981 Da
logP
-1.53Crippen estimate
Polar surface area
117.9 Ų
H-bond donors / acceptors
5 / 5
Rotatable bonds
3
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
1341-23-7
SMILES
N=C(O)c1ccc[n+]([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1
InChIKey
JLEBZPBDRKPWTD-TURQNECASA-O
InChI
InChI=1S/C11H14N2O5/c12-10(17)6-2-1-3-13(4-6)11-9(16)8(15)7(5-14)18-11/h1-4,7-9,11,14-16H,5H2,(H-,12,17)/p+1/t7-,8-,9-,11-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Pyridinium, 3-(aminocarbonyl)-1-β-D-ribofuranosyl-
  • Pyridinium, 3-carbamoyl-1-β-D-ribofuranosyl-
  • 3-(Aminocarbonyl)-1-β-D-ribofuranosylpyridinium
  • Nicotinamide ribonucleoside
  • Nicotinamide ribose
  • 3-Pyridinecarboxamide, 1-β-D-ribosyl-
  • Ribosylnicotinamide

Work with Nicotinamide riboside

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Nicotinamide riboside chloride23111-00-469 % similar Nicotinamide mononucleotide1094-61-764 % similar Nicotinamide adenine dinucleotide53-84-943 % similar Nicotinamide N-oxide1986-81-841 % similar Nicotinamide adenine dinucleotide phosphate53-59-839 % similar Aicar2627-69-239 % similar Benzamide55-21-036 % similar Thio-nad4090-29-336 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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