Chemical Compound

NICOTINAMIDE ADENINE DINUCLEOTIDE, [ADENINE-2,8-3H]

CAS Registry Number 107688-05-1
NICOTINAMIDE ADENINE DINUCLEOTIDE, [ADENINE-2,8-3H] chemical structure
Primary Record

NICOTINAMIDE ADENINE DINUCLEOTIDE, [ADENINE-2,8-3H]

In stock
1,833 g
Purity
98.6 %
CAS
107688-05-1

Compound Identifiers & Properties

CAS
107688-05-1
PubChem CID
163184647
SMILES
[3H]C1=NC(=N)C2=C(N1)N(C(=N2)[3H])[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)([O-])O[C@@H]4[C@H](O[C@H]([C@@H]4O)[N+]5=CC=CC(=C5)C(=O)N)CO)O)O
Canonical SMILES
[3H]c1nc(=N)c2nc([3H])n([C@@H]3O[C@H](COP(=O)(O)OP(=O)([O-])O[C@H]4[C@@H](O)[C@H]([n+]5cccc(C(N)=O)c5)O[C@@H]4CO)[C@@H](O)[C@H]3O)c2[nH]1

Names & Synonyms

  • NICOTINAMIDE ADENINE DINUCLEOTIDE, [ADENINE-2,8-3H]
  • [[(2R,3S,4R,5R)-5-(6-amino-2,8-ditritiopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] phosphate
  • 107688-05-1