Chemical Compound

Thionicotinamide nad

CAS Registry Number 4090-29-3
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Thionicotinamide nad chemical structure
Primary Record

Thionicotinamide nad

In stock
3,940 g
Purity
98.7 %
CAS
4090-29-3

Compound Identifiers & Properties

CAS
4090-29-3
PubChem CID
91972082
SMILES
C1=CC(=C[N+](=C1)[C@H]2[C@H](C([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3C([C@@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=S)N
Canonical SMILES
NC(=S)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@@H](O)C3O)C(O)[C@@H]2O)c1

Names & Synonyms

  • Thionicotinamide nad
  • Thionicotinamide-DPN
  • Thionicotinamide-NAD
  • Thionicotinamide adenine dinucleotide
  • C21H27N7O13P2S
  • EINECS 223-828-6
  • C21-H27-N7-O13-P2-S
  • T2979
  • 4090-29-3
  • Adenosine 5'-(trihydrogen diphosphate), 5'.fwdarw.5'-ester with 3-(aminothioxomethyl)-1-.beta.-D-ribofuranosylpyridinium hydroxide, inner salt
  • Adenosine 5'-(trihydrogen diphosphate), 5'5'-ester with 3-(aminothioxomethyl)-1-beta-D-ribofuranosylpyridinium--ate