Chemical Compound

MFCD30724412

CAS Registry Number 20111-18-6
MFCD30724412 chemical structure
Primary Record

MFCD30724412

In stock
7,784 g
Purity
99.7 %
CAS
20111-18-6

Compound Identifiers & Properties

CAS
20111-18-6
PubChem CID
138376244
SMILES
C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=N)[O-].O.O.[Na+]
Canonical SMILES
N=C([O-])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)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O.[Na+]

Names & Synonyms

  • MFCD30724412
  • b-Nicotinamide adenine dinucleotide monosodium salt dihydrate
  • 20111-18-6